ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate
TL;DR: ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate (CAS 339112-65-1) is a chemical compound with molecular formula C16H14ClN3O2 and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(6-chloro-3-pyridinyl)benzimidazol-1-yl]acetate
Also Known As: ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate, ethyl 2-[2-(6-chloropyridin-3-yl)-1H-1,3-benzodiazol-1-yl]acetate, ethyl 2-[2-(6-chloropyridin-3-yl)benzimidazol-1-yl]acetate, Ethyl 2-(2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl)acetate, ethyl 2-[2-(6-chloro-3-pyridyl)benzimidazol-1-yl]acetate
| Molecular Formula | C16H14ClN3O2 |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 3.3148 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.07745 |
| Heavy Atoms | 22 |
| Complexity | 811.8739 |
Chemical Identifiers
| CAS Number | 339112-65-1 |
|---|---|
| SMILES | CCOC(=O)CN1C2=CC=CC=C2N=C1C3=CN=C(C=C3)Cl |
Product Overview
ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate (CAS 339112-65-1), with molecular formula C16H14ClN3O2 and molecular weight 315.08 g/mol. IUPAC: ethyl 2-[2-(6-chloro-3-pyridinyl)benzimidazol-1-yl]acetate.
Chemical Property Profile of ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate
Property Insights of ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate
The XLogP value of 3.3148 indicates that ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.01 Ų, ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate has 0 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 ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate?
The CAS number of ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate is 339112-65-1.
What is the molecular formula of ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate?
The molecular formula of ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate is C16H14ClN3O2.
What is the molecular weight of ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate?
The molecular weight of ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate is 315.08 g/mol.
Where can I buy ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate?
You can request a quote for ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[2-(6-chloro-3-pyridinyl)-1H-1,3-benzimidazol-1-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.