1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester
TL;DR: 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester (CAS 79759-36-7) is a chemical compound with molecular formula C17H15ClN2O3 and molecular weight 330.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(5-chloro-2-oxo-3-phenylbenzimidazol-1-yl)acetate
Also Known As: 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester, Ethyl 2,3-dihydro-5-chloro-2-oxo-3-phenyl-1H-benzimidazole-1-acetate, Ethyl (5-chloro-2-oxo-3-phenyl-2,3-dihydro-1H-benzimidazol-1-yl)acetate, ethyl 2-(5-chloro-2-oxo-3-phenylbenzimidazol-1-yl)acetate, Ethyl (5-chloro-2-oxo-3-phenyl-2,3-dihydro-1H-1,3-benzimidazol-1-yl)acetate
| Molecular Formula | C17H15ClN2O3 |
|---|---|
| Molecular Weight | 330.08 g/mol |
| LogP | 3.0087 |
| Topological Polar Surface Area | 53.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.07712 |
| Heavy Atoms | 23 |
| Complexity | 912.72833 |
Chemical Identifiers
| CAS Number | 79759-36-7 |
|---|---|
| SMILES | CCOC(=O)CN1C2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3 |
Product Overview
1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester (CAS 79759-36-7), with molecular formula C17H15ClN2O3 and molecular weight 330.08 g/mol. IUPAC: ethyl 2-(5-chloro-2-oxo-3-phenylbenzimidazol-1-yl)acetate.
Chemical Property Profile of 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester
Property Insights of 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester
The XLogP value of 3.0087 indicates that 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.23 Ų, 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester has 0 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 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester?
The CAS number of 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester is 79759-36-7.
What is the molecular formula of 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester?
The molecular formula of 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester is C17H15ClN2O3.
What is the molecular weight of 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester?
The molecular weight of 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester is 330.08 g/mol.
Where can I buy 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester?
You can request a quote for 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole-1-acetic acid, 2,3-dihydro-5-chloro-2-oxo-3-phenyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.