![2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid structure](/static/products/882/88269-68-5.png)
2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
TL;DR: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid (CAS 88269-68-5) 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.
2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Also Known As: 2-[ sulfanyl]propanoicacid, Propanoicacid, 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-, 2-(5-chlorobenzimidazol-2-ylthio)propanoic acid, 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid, propanoic acid, 2-[(5-chloro-1h-benzimidazol-2-yl)thio]-
| Molecular Formula | C10H9ClN2O2S |
|---|---|
| Molecular Weight | 256.01 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.00732 |
| Heavy Atoms | 16 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 88269-68-5 |
|---|---|
| SMILES | CC(C(=O)O)SC1=NC2=C(N1)C=C(C=C2)Cl |
| InChIKey | CIWRHZVULSVWEX-UHFFFAOYSA-N |
Product Overview
2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid (CAS 88269-68-5), with molecular formula C10H9ClN2O2S and molecular weight 256.01 g/mol. IUPAC: 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid.
Chemical Property Profile of 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
Property Insights of 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid
The XLogP value of 3.2 indicates that 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid. Following Lipinski's Rule of Five, 2-[(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 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
The CAS number of 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid is 88269-68-5.
What is the molecular formula of 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
The molecular formula of 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid is C10H9ClN2O2S.
What is the molecular weight of 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
The molecular weight of 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid is 256.01 g/mol.
Where can I buy 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
You can request a quote for 2-[(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 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.