BAS 02496285
TL;DR: BAS 02496285 (CAS 335407-47-1) is a chemical compound with molecular formula C21H22N2O8S and molecular weight 462.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(4-ethoxycarbonylphenyl)carbamoyl]-2-[(2-ethoxy-2-oxoacetyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: BAS 02496285, Methyl 2-((5,6-dimethyl-2H-pyran-2-yl)(ethoxy)amino)-5-((4-(ethoxycarbonyl)phenyl)carbamoyl)-4-methylthiophene-3-carboxylate, 5-(4-Ethoxycarbonyl-phenylcarbamoyl)-2-(ethoxyoxalyl-amino)-4-methyl-thiophene-3-carboxylic acid methyl ester, methyl 5-[(4-ethoxycarbonylphenyl)carbamoyl]-2-[(2-ethoxy-2-oxoacetyl)amino]-4-methylthiophene-3-carboxylate
| Molecular Formula | C21H22N2O8S |
|---|---|
| Molecular Weight | 462.11 g/mol |
| LogP | 2.77372 |
| Topological Polar Surface Area | 137.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.10968 |
| Heavy Atoms | 32 |
| Complexity | 1042.8142 |
Chemical Identifiers
| CAS Number | 335407-47-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C(=O)OCC)C(=O)OC)C |
Product Overview
BAS 02496285 (CAS 335407-47-1), with molecular formula C21H22N2O8S and molecular weight 462.11 g/mol. IUPAC: methyl 5-[(4-ethoxycarbonylphenyl)carbamoyl]-2-[(2-ethoxy-2-oxoacetyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of BAS 02496285
Property Insights of BAS 02496285
The XLogP value of 2.77372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02496285. The TPSA of 137.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02496285. Following Lipinski's Rule of Five, BAS 02496285 has 2 hydrogen bond donor(s) and 9 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 BAS 02496285?
The CAS number of BAS 02496285 is 335407-47-1.
What is the molecular formula of BAS 02496285?
The molecular formula of BAS 02496285 is C21H22N2O8S.
What is the molecular weight of BAS 02496285?
The molecular weight of BAS 02496285 is 462.11 g/mol.
Where can I buy BAS 02496285?
You can request a quote for BAS 02496285 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02496285?
Yes, KEHONG BIO provides custom synthesis services for BAS 02496285 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.