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RefChem:238177 structure
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RefChem:238177

TL;DR: RefChem:238177 (CAS 153667-41-5) is a chemical compound with molecular formula C8H14Br2N4O3 and molecular weight 371.94327 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2R)-1-(2-bromoethylamino)-3-(2-nitroimidazol-1-yl)propan-2-ol;hydrobromide

Also Known As: PD 144872, RB 6145, 1H-Imidazole-1-ethanol, alpha-(((2-bromoethyl)amino)methyl)-2-nitro-, monohydrobromide, (R)-, (R)-alpha-(((2-Bromoethyl)amino)methyl)-2-nitro-1H-imidazole-1-ethanol monohydrobromide, (2R)-1-(2-bromoethylamino)-3-(2-nitroimidazol-1-yl)propan-2-ol;hydrobromide

CAS Number
153667-41-5
Molecular Formula
C8H14Br2N4O3
Molecular Weight
371.94327 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Pharmaceutical Intermediates (3 patents)

Technical Specifications

Molecular FormulaC8H14Br2N4O3
Molecular Weight371.94327 g/mol
XLogP0.7146
Topological Polar Surface Area (TPSA)95.9 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass371.94327 Da
Heavy Atoms17
Complexity226.0
SMILESC1=CN(C(=N1)[N+](=O)[O-])C[C@@H](CNCCBr)O.Br
InChIKeyXPBJPGMCFKYBBV-OGFXRTJISA-N

Chemical Property Profile of RefChem:238177

XLogP
0.7146
TPSA (Topological Polar Surface Area)
95.9
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
17
Complexity
226.0
Exact Mass
371.94327
Monoisotopic Mass
371.94327
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of RefChem:238177

The XLogP value of 0.7146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:238177. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:238177. Following Lipinski's Rule of Five, RefChem:238177 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:238177?

The CAS number of RefChem:238177 is 153667-41-5.

What is the molecular formula of RefChem:238177?

The molecular formula of RefChem:238177 is C8H14Br2N4O3.

What is the molecular weight of RefChem:238177?

The molecular weight of RefChem:238177 is 371.94327 g/mol.

Where can I buy RefChem:238177?

You can request a quote for RefChem:238177 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:238177?

Yes, CoreyChem provides custom synthesis services for RefChem:238177 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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