2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid
TL;DR: 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid (CAS 52107-87-6) 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.
2-(1H-benzimidazol-2-ylsulfanyl)propanoic acid
Also Known As: 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid, ChemDiv1_002493, 4-Iodo-3-methylbenzoic acid, 2-(1H-benzoimidazol-2-ylsulfanyl)propionicacid, 2-(1h-benzoimidazol-2-ylsulfanyl)propionic acid
| Molecular Formula | C10H10N2O2S |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.0463 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 52107-87-6 |
|---|---|
| SMILES | CC(C(=O)O)SC1=NC2=CC=CC=C2N1 |
| InChIKey | BPGKQRFDAPZJPQ-UHFFFAOYSA-N |
Product Overview
2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid (CAS 52107-87-6), with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)propanoic acid.
Chemical Property Profile of 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid
Property Insights of 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid. Following Lipinski's Rule of Five, 2-(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 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid?
The CAS number of 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid is 52107-87-6.
What is the molecular formula of 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid?
The molecular formula of 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid is C10H10N2O2S.
What is the molecular weight of 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid?
The molecular weight of 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid is 222.05 g/mol.
Where can I buy 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid?
You can request a quote for 2-(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 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-Benzimidazol-2-ylsulfanyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.