![ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate structure](/static/products/467/467447-66-1.png)
ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate
TL;DR: ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate (CAS 467447-66-1) is a chemical compound with molecular formula C16H23ClN2O5 and molecular weight 358.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[2-(2-ethoxy-2-oxoethyl)benzimidazol-1-yl]propanoate;hydrate;hydrochloride
Also Known As: ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate, ethyl 3-[2-(2-ethoxy-2-oxoethyl)benzimidazol-1-yl]propanoate hydrate hydrochloride
| Molecular Formula | C16H23ClN2O5 |
|---|---|
| Molecular Weight | 358.13 g/mol |
| LogP | 1.6922 |
| Topological Polar Surface Area | 101.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.12955 |
| Heavy Atoms | 24 |
| Complexity | 671.53156 |
Chemical Identifiers
| CAS Number | 467447-66-1 |
|---|---|
| SMILES | CCOC(=O)CCN1C2=CC=CC=C2N=C1CC(=O)OCC.O.Cl |
Product Overview
ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate (CAS 467447-66-1), with molecular formula C16H23ClN2O5 and molecular weight 358.13 g/mol. IUPAC: ethyl 3-[2-(2-ethoxy-2-oxoethyl)benzimidazol-1-yl]propanoate;hydrate;hydrochloride.
Chemical Property Profile of ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate
Property Insights of ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate
The XLogP value of 1.6922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate. The TPSA of 101.92 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate. Following Lipinski's Rule of Five, ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate has 0 hydrogen bond donor(s) and 5 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 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate?
The CAS number of ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate is 467447-66-1.
What is the molecular formula of ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate?
The molecular formula of ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate is C16H23ClN2O5.
What is the molecular weight of ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate?
The molecular weight of ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate is 358.13 g/mol.
Where can I buy ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate?
You can request a quote for ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(2-(2-ethoxy-2-oxoethyl)-1H-benzo[d]imidazol-1-yl)propanoate hydrochloride hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.