7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone

Basic Information

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CAS Number

55837-20-2

Molecular Formula

C16H17BrClN3O3

Molecular Weight

414.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

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

Melting Point

>150°C dec.

Boiling Point

595.8±60.0°C at 760 mmHg

Solubility

N/A

SMILES

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C1CC(C(NC1)CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br)O

InChI

InChI=1S/C16H17BrClN3O3/c17-11-6-13-10(5-12(11)18)16(24)21(8-20-13)7-9(22)4-14-15(23)2-1-3-19-14/h5-6,8,14-15,19,23H,1-4,7H2/t14-,15+/m0/s1

InChIKey

LVASCWIMLIKXLA-LSDHHAIUSA-N

LogP

1.8844999999999996

Topological Polar Surface Area

84.22 Å²

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

533

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

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

Storage Conditions

2-8℃

Synonyms & References

English

MS-27185
4(3H)-Quinazolinone, 7-bromo-6-chloro-3-(3-((2S,3R)-3-hydroxy-2-piperidinyl)-2-oxopropyl)-
DTXSID0048260
7-bromo-6-chloro-3-[3-[(2S,3R)-3-hydroxypiperidin-2-yl]-2-oxopropyl]quinazolin-4-one
6-Chloro-7-bromofebrifugine
CS-5485
(-)-Halofuginone
CHEMBL1199539
empostatin
55837-20-2
AKOS026669540
4(3H)-Quinazolinone, 7-bromo-6-chloro-3-[3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl]-
7-Bromo-6-chloro-3-[3-[(2R,3S)-3-hydroxy-2-piperidyl]-2-oxopropyl]-4(3H)-Quinazolinone
BCBcMAP01_000107
7-Bromo-6-chloro-3-(3-((2S,3R)-3-hydroxy-2-piperidinyl)-2-oxopropyl)-4(3H)-quinazolinone
SCHEMBL25596
Halofuginone
7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone
7-bromo-6-chloro-3-(3-((2S,3R)-3-hydroxypiperidin-2-yl)-2-oxopropyl)quinazolin-4(3H)-one
Halocur [veterinary] (TN)
7695-84-3
NVY6A324PU
RU-19110
UNII-NVY6A324PU
BCBcMAP01_000063
EX-A5113
7-bromo-6-chloro-3-(3-((2S,3R)-3-hydroxypiperidin-2-yl)-2-oxopropyl)quinazolin-4(3H)-one.
HY-N1584
AMY39119
Halofuginone, (-)-
Q-201182

MDL Number

MFCD09834143

FAQ

What is 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2)?

7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone is a synthetic organic compound with the CAS number 55837-20-2. It contains a quinazolinone ring substituted with bromo and chloro groups, along with a piperidine-derived functional group. This compound is known for its complex structure and potential pharmacological activity, often used in research and drug development.

What are the main uses of 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2)?

This compound is primarily used in pharmaceutical research as a potential inhibitor of certain enzymes, particularly those involved in cancer-related pathways. It may also be employed in the synthesis of other bioactive molecules and is of interest in medicinal chemistry for its structural versatility and biological activity.

Is 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2) safe?

Safety data for this compound is limited, but as a brominated and chlorinated organic compound, it may pose health risks upon prolonged exposure. Proper handling, such as wearing gloves and a lab coat, is recommended. It should be used in well-ventilated areas and in compliance with chemical safety standards to minimize potential hazards.

How should 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2) be stored?

This compound should be stored in a cool, dry, and dark place, away from incompatible materials. It is typically kept in a sealed container at a temperature below 25°C and in low humidity. Avoid exposure to light and ensure proper ventilation to maintain stability and prevent degradation.

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Compound Q&A

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Compound Q&A

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Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

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Compound Q&A

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7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone | CAS No. 55837-20-2

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Melting Point

Boiling Point

Solubility

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Storage Conditions

Synonyms & References

English

MDL Number

FAQ

What is 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2)?

What are the main uses of 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2)?

Is 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2) safe?

How should 7-Bromo-6-chloro-3-{3-[(2S,3R)-3-hydroxy-2-piperidinyl]-2-oxopropyl}-4(3H)-quinazolinone (CAS: 55837-20-2) be stored?

Related Compounds

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