(3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid

Basic Information

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CAS Number

1564286-55-0

Molecular Formula

C26H32BrN5O6

Molecular Weight

590.48 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

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

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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NCC(=O)N(C(=O)c1cc(O)cc(c1)NC1=NCC(CN1)O)CC(c1cc(Br)cc(c1)C(C)(C)C)C(=O)O

InChI

InChI=1S/C26H32BrN5O6/c1-26(2,3)16-4-14(5-17(27)8-16)21(10-23(36)37)32-22(35)13-28-24(38)15-6-18(9-19(33)7-15)31-25-29-11-20(34)12-30-25/h4-9,20-21,33-34H,10-13H2,1-3H3,(H,28,38)(H,32,35)(H,36,37)(H2,29,30,31)/t21-/m0/s1

InChIKey

YDHAGPCZRFQPOI-NRFANRHFSA-N

LogP

1.9800999999999995

Topological Polar Surface Area

177.57999999999998 Å²

Hydrogen Bond Donor/Acceptor

7 / 11

Complexity

881

Safety Information

View Safety Information

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

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

Synonyms & References

English

CWHM12
CWHM-12
(3S)-3-(3-bromo-5-(tert-butyl)phenyl)-3-(2-(3-hydroxy-5-((5-hydroxy-1,4,5,6-tetrahydropyrimidin-2-yl)amino)benzamido)acetamido)propanoic acid
CWHM 12
GTPL10495
AOB2397
(3S)-3-(3-bromo-5-tert-butylphenyl)-3-[[2-[[3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydropyrimidin-2-yl)amino]benzoyl]amino]acetyl]amino]propanoic acid
BDBM50497716
(3S)-3-(3-bromo-5-tert-but

MDL Number

MFCD28385850

FAQ

What regulatory guidelines apply to (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0)?

This compound is subject to GHS classification, REACH regulations, and may also be governed by FDA and EPA requirements for import and use in the United States. Specific safety data sheets (SDS) and material safety data sheets (MSDS) should be consulted for detailed guidelines on handling and disposal.

Are there alternatives to (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0) in synthesis?

There are several alternatives depending on the specific synthetic route. Common substitutes include isomers, analogs such as (2S)-2-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-2-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid, and other reagents like 3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]-3-[3-bromo-5-(2-methyl-2-propanyl)phenyl]propanoic acid.

What is the market or research trend for (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0)?

The market trend for this compound is driven by increasing research in pharmaceutical applications, particularly in drug development. There is a growing interest in understanding its biological activities and potential uses as a pharmacological agent. Research trends focus on its effects on various target proteins and its therapeutic potential.

How should waste containing (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0) be handled?

Waste containing this compound should be collected in a sealed container and disposed of according to local hazardous waste regulations. It is recommended to incinerate or use professional waste disposal services to ensure compliance with environmental protection standards. Proper labeling and documentation of the waste are essential to avoid contamination and ensure safety.

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1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

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(3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid | CAS No. 1564286-55-0

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Synonyms & References

English

MDL Number

FAQ

What regulatory guidelines apply to (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0)?

Are there alternatives to (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0) in synthesis?

What is the market or research trend for (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0)?

How should waste containing (3S)-3-[3-Bromo-5-(2-methyl-2-propanyl)phenyl]-3-[(N-{3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydro-2-pyrimidinyl)amino]benzoyl}glycyl)amino]propanoic acid (CAS: 1564286-55-0) be handled?

Related Compounds

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