2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid
TL;DR: 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid (CAS 353482-59-4) is a chemical compound with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzylbenzimidazol-2-yl)sulfanylpropanoic acid
Also Known As: ChemDiv2_004080, IDI1_002795, 2-(1-benzylbenzimidazol-2-yl)sulfanylpropanoic acid, AB00098718-01, AN-023/12770001
| Molecular Formula | C17H16N2O2S |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 3.6498 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.09326 |
| Heavy Atoms | 22 |
| Complexity | 798.784 |
Chemical Identifiers
| CAS Number | 353482-59-4 |
|---|---|
| SMILES | CC(C(=O)O)SC1=NC2=CC=CC=C2N1CC3=CC=CC=C3 |
Product Overview
2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid (CAS 353482-59-4), with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol. IUPAC: 2-(1-benzylbenzimidazol-2-yl)sulfanylpropanoic acid.
Chemical Property Profile of 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid
Property Insights of 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid
The XLogP value of 3.6498 indicates that 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.12 Ų, 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid has 1 hydrogen bond donor(s) and 3 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-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid?
The CAS number of 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid is 353482-59-4.
What is the molecular formula of 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid?
The molecular formula of 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid is C17H16N2O2S.
What is the molecular weight of 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid?
The molecular weight of 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid is 312.09 g/mol.
Where can I buy 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid?
You can request a quote for 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Benzylbenzimidazol-2-yl)sulfanylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.