5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester
TL;DR: 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester (CAS 302582-89-4) is a chemical compound with molecular formula C15H13Cl2NO3S and molecular weight 357.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-chloro-2-[(2-chloroacetyl)amino]-4-phenylthiophene-3-carboxylate
Also Known As: 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester, ethyl 5-chloro-2-(2-chloroacetamido)-4-phenylthiophene-3-carboxylate, ethyl 5-chloro-2-[(2-chloroacetyl)amino]-4-phenylthiophene-3-carboxylate, ethyl5-chloro-2-(2-chloroacetamido)-4-phenylthiophene-3-carboxylate, ethyl 5-chloro-2-(2-chloroacetylamino)-4-phenylthiophene-3-carboxylate
| Molecular Formula | C15H13Cl2NO3S |
|---|---|
| Molecular Weight | 357.00 g/mol |
| LogP | 4.4225 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.99933 |
| Heavy Atoms | 22 |
| Complexity | 685.59607 |
Chemical Identifiers
| CAS Number | 302582-89-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)CCl |
Product Overview
5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester (CAS 302582-89-4), with molecular formula C15H13Cl2NO3S and molecular weight 357.00 g/mol. IUPAC: ethyl 5-chloro-2-[(2-chloroacetyl)amino]-4-phenylthiophene-3-carboxylate.
Chemical Property Profile of 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester
Property Insights of 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester
The XLogP value of 4.4225 indicates that 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester 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 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester?
The CAS number of 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester is 302582-89-4.
What is the molecular formula of 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester?
The molecular formula of 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester is C15H13Cl2NO3S.
What is the molecular weight of 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester?
The molecular weight of 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester is 357.00 g/mol.
Where can I buy 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester?
You can request a quote for 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-(2-chloro-acetylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.