![3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid structure](/static/products/925/92503-66-7.png)
3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
TL;DR: 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid (CAS 92503-66-7) is a chemical compound with molecular formula C10H9ClN2O2S and molecular weight 256.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Also Known As: 3-[ sulfanyl]propanoicacid, 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid, propanoic acid, 3-[(5-chloro-1h-benzimidazol-2-yl)thio]-, 3-((5-chloro-1h-benzimidazol-2-yl)thio)propanoic acid, 3-[(5-chloro-1H-1,3-benzodiazol-2-yl)sulfanyl]propanoic acid
| Molecular Formula | C10H9ClN2O2S |
|---|---|
| Molecular Weight | 256.01 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.00732 |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 92503-66-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)NC(=N2)SCCC(=O)O |
| InChIKey | MFRQXJNAHCIHGG-UHFFFAOYSA-N |
Product Overview
3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid (CAS 92503-66-7), with molecular formula C10H9ClN2O2S and molecular weight 256.01 g/mol. IUPAC: 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid.
Chemical Property Profile of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Property Insights of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid. Following Lipinski's Rule of Five, 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
The CAS number of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid is 92503-66-7.
What is the molecular formula of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
The molecular formula of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid is C10H9ClN2O2S.
What is the molecular weight of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
The molecular weight of 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid is 256.01 g/mol.
Where can I buy 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
You can request a quote for 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.