![ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride structure](/static/products/2999/299901-47-6.webp)
ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride
TL;DR: ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride (CAS 299901-47-6) is a chemical compound with molecular formula C11H13ClN2O2S and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1H-benzimidazol-2-ylsulfanyl)acetate;hydrochloride
Also Known As: ethyl 2-(1H-benzo[d]imidazol-2-ylthio)acetate hydrochloride, ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride, F1279-0017, ethyl 2-(1H-benzimidazol-2-ylsulfanyl)acetate hydrochloride, ethyl 2-(1H-benzimidazol-2-ylsulfanyl)acetate;hydrochloride
| Molecular Formula | C11H13ClN2O2S |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 2.6399 |
| Topological Polar Surface Area | 54.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.03864 |
| Heavy Atoms | 17 |
| Complexity | 467.932 |
Chemical Identifiers
| CAS Number | 299901-47-6 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=CC=CC=C2N1.Cl |
Product Overview
ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride (CAS 299901-47-6), with molecular formula C11H13ClN2O2S and molecular weight 272.04 g/mol. IUPAC: ethyl 2-(1H-benzimidazol-2-ylsulfanyl)acetate;hydrochloride.
Chemical Property Profile of ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride
Property Insights of ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride
The XLogP value of 2.6399 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride. With a topological polar surface area (TPSA) of 54.98 Ų, ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride has 1 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-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride?
The CAS number of ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride is 299901-47-6.
What is the molecular formula of ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride?
The molecular formula of ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride is C11H13ClN2O2S.
What is the molecular weight of ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride?
The molecular weight of ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride is 272.04 g/mol.
Where can I buy ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride?
You can request a quote for ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-((1H-benzo[d]imidazol-2-yl)thio)acetate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.