3-(1-Ethylbenzimidazol-2-yl)propanoic acid
TL;DR: 3-(1-Ethylbenzimidazol-2-yl)propanoic acid (CAS 879722-72-2) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-ethylbenzimidazol-2-yl)propanoic acid
Also Known As: ASN 13125109, 3-(1-ethylbenzimidazol-2-yl)propanoic acid, 1H-Benzimidazole-2-propanoic acid, 1-ethyl, 3-(1-Ethyl-1H-benzoimidazol-2-yl)-propionic acid, BRD-K99165910-001-01-5
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 2.0734 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 516.71313 |
Chemical Identifiers
| CAS Number | 879722-72-2 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2N=C1CCC(=O)O |
Product Overview
3-(1-Ethylbenzimidazol-2-yl)propanoic acid (CAS 879722-72-2), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 3-(1-ethylbenzimidazol-2-yl)propanoic acid.
Chemical Property Profile of 3-(1-Ethylbenzimidazol-2-yl)propanoic acid
Property Insights of 3-(1-Ethylbenzimidazol-2-yl)propanoic acid
The XLogP value of 2.0734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Ethylbenzimidazol-2-yl)propanoic acid. With a topological polar surface area (TPSA) of 55.12 Ų, 3-(1-Ethylbenzimidazol-2-yl)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Ethylbenzimidazol-2-yl)propanoic acid has 1 hydrogen bond donor(s) and 2 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-(1-Ethylbenzimidazol-2-yl)propanoic acid?
The CAS number of 3-(1-Ethylbenzimidazol-2-yl)propanoic acid is 879722-72-2.
What is the molecular formula of 3-(1-Ethylbenzimidazol-2-yl)propanoic acid?
The molecular formula of 3-(1-Ethylbenzimidazol-2-yl)propanoic acid is C12H14N2O2.
What is the molecular weight of 3-(1-Ethylbenzimidazol-2-yl)propanoic acid?
The molecular weight of 3-(1-Ethylbenzimidazol-2-yl)propanoic acid is 218.11 g/mol.
Where can I buy 3-(1-Ethylbenzimidazol-2-yl)propanoic acid?
You can request a quote for 3-(1-Ethylbenzimidazol-2-yl)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-(1-Ethylbenzimidazol-2-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Ethylbenzimidazol-2-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.