(3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid

Basic Information

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CAS Number

134523-00-5

Molecular Formula

C33H35FN2O5

Molecular Weight

558.65 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

176-178 ºC

Boiling Point

722.2°C at 760 mmHg

Density

6.95X10-25 mm Hg at 25 deg C (est)

Flash Point

390.572ºC

SMILES

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CC(C)C1=C(C(=C(N1CCC(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-,27-/m1/s1

InChIKey

XUKUURHRXDUEBC-KAYWLYCHSA-N

LogP

6.313600000000007

Topological Polar Surface Area

111.79000000000002 Å²

Hydrogen Bond Donor/Acceptor

4 / 7

Complexity

822

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

BRD-K69726342-001-02-6
Sortis (TN)
(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid
(3R,5R)-7-[3-(anilinocarbonyl)-5-(4-fluorophenyl)-4-phenyl-2-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid
CI-981
A0JWA85V8F
DTXSID60274003
Tox21_302417
7-(2-(4-FLUORO-PHENYL)-5-ISOPROPYL-3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-1-YL)-3,5-DIHYDROXY-HEPTANOIC ACID
EN300-18527331
Atorvastatin & Primycin
NS00009054
rel-Atorvastatin
(3R,5R)-7-[2-(4-FLUOROPHENYL)-3-PHENYL-4-(PHENYLCARBAMOYL)-5-PROPAN-2-YL-PYRROL-1-YL]-3,5-DIHYDROXY-HEPTANOIC ACID
UNII-A0JWA85V8F
1H-PYRROLE-1-HEPTANOIC ACID, 2-(4-FLUOROPHENYL)-.BETA.,.DELTA.-DIHYDROXY-5-(1-METHYLETHYL)-3-PHENYL-4-((PHENYLAMINO)CARBONYL)-, (R-(R*,R*))-
Atorvastatin is known as an HMG-CoA reductase inhibitor.
Lipitor(TM)
Tozalip
HSDB 7039
A806791
Atorlip
AC-9386
ATORVASTATIN CALCIUM
atrovastin
Atofast
sodium 7-[5-(4-fluorophenyl)-2-isopropyl-4-phenyl-3-(phenylcarbamoyl)-2,3-dihydropyrrol-1-yl]-3,5-dihydroxy-heptanoate
HY-B0589
Lipilou
atorvastatin
A802259

MDL Number

MFCD00899261

Customs Code

2942000000

FAQ

What is (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5)?

This compound is a complex organic molecule with the CAS number 134523-00-5. It features a heptanoic acid backbone with multiple aromatic rings and functional groups, including 4-fluorophenyl, phenylcarbamoyl, and hydroxyl groups. Its stereochemistry (3R,5R) indicates specific spatial configurations, and it is characterized by high molecular complexity, making it relevant in pharmaceutical and research contexts.

What are the main uses of (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5)?

This compound is primarily used in pharmaceutical research as a potential therapeutic agent or intermediate. Its unique structure suggests applications in drug development targeting specific biological pathways, though detailed industrial or food uses are not widely documented. It may also be employed in biochemical studies due to its complex functional groups and stereochemistry.

Is (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5) safe?

Safety of this compound depends on exposure conditions and handling. While no specific toxicological data is publicly available, it should be treated with standard chemical safety precautions. Protective measures include wearing gloves, goggles, and lab coats, and ensuring proper ventilation. Always follow OSHA and EPA guidelines for handling such complex organic compounds.

How should (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5) be stored?

Store this compound in a cool, dry place (ideally 2-8°C), away from light and moisture. Use airtight, sealed containers to maintain stability. Avoid exposure to incompatible substances and ensure proper labeling. Stability is optimal under controlled storage conditions, as specified in its chemical safety data sheet (CSDS).

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Compound Q&A

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Compound Q&A

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Compound Q&A

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(3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid | CAS No. 134523-00-5

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Melting Point

Boiling Point

Density

Flash Point

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Synonyms & References

English

MDL Number

Customs Code

FAQ

What is (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5)?

What are the main uses of (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5)?

Is (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5) safe?

How should (3R,5R)-7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (CAS: 134523-00-5) be stored?

Related Compounds

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What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

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