AP-853/42000735
TL;DR: AP-853/42000735 (CAS 663200-35-9) is a chemical compound with molecular formula C20H21ClN2O4S and molecular weight 420.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[1-(4-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: AP-853/42000735, ethyl 2-({[1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate, ethyl 2-[[1-(4-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate, ethyl 2-({[1-(4-chlorophenyl)-5-oxo-3-pyrrolidinyl]carbonyl}amino)-4,5-dimethyl-3-thiophenecarboxylate, ethyl 2-(1-(4-chlorophenyl)-5-oxopyrrolidine-3-carboxamido)-4,5-dimethylthiophene-3-carboxylate
| Molecular Formula | C20H21ClN2O4S |
|---|---|
| Molecular Weight | 420.09 g/mol |
| LogP | 4.18664 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.09106 |
| Heavy Atoms | 28 |
| Complexity | 923.03204 |
Chemical Identifiers
| CAS Number | 663200-35-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Cl |
Product Overview
AP-853/42000735 (CAS 663200-35-9), with molecular formula C20H21ClN2O4S and molecular weight 420.09 g/mol. IUPAC: ethyl 2-[[1-(4-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of AP-853/42000735
Property Insights of AP-853/42000735
The XLogP value of 4.18664 indicates that AP-853/42000735 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-853/42000735. Following Lipinski's Rule of Five, AP-853/42000735 has 1 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 AP-853/42000735?
The CAS number of AP-853/42000735 is 663200-35-9.
What is the molecular formula of AP-853/42000735?
The molecular formula of AP-853/42000735 is C20H21ClN2O4S.
What is the molecular weight of AP-853/42000735?
The molecular weight of AP-853/42000735 is 420.09 g/mol.
Where can I buy AP-853/42000735?
You can request a quote for AP-853/42000735 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-853/42000735?
Yes, KEHONG BIO provides custom synthesis services for AP-853/42000735 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.