3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid
TL;DR: 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid (CAS 32051-90-4) is a chemical compound with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid
Also Known As: 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid, 3-((1H-Benzo[d]imidazol-2-yl)thio)propanoic acid, 3-(1H-1,3-benzodiazol-2-ylsulfanyl)propanoic acid, 3-benzimidazol-2-ylthiopropanoic acid, BAS 01860468
| Molecular Formula | C10H10N2O2S |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.0463 |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 32051-90-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)SCCC(=O)O |
| InChIKey | LUFHFCKOUJEWSY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid (CAS 32051-90-4), with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol. IUPAC: 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid.
Chemical Property Profile of 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid
Property Insights of 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid. Following Lipinski's Rule of Five, 3-(1H-benzimidazol-2-ylsulfanyl)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-(1H-benzimidazol-2-ylsulfanyl)propanoic acid?
The CAS number of 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid is 32051-90-4.
What is the molecular formula of 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid?
The molecular formula of 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid is C10H10N2O2S.
What is the molecular weight of 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid?
The molecular weight of 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid is 222.05 g/mol.
Where can I buy 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid?
You can request a quote for 3-(1H-benzimidazol-2-ylsulfanyl)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-(1H-benzimidazol-2-ylsulfanyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-benzimidazol-2-ylsulfanyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.