BAS 02495979
TL;DR: BAS 02495979 (CAS 335406-04-7) is a chemical compound with molecular formula C19H21ClN2O4S and molecular weight 408.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-chlorobenzoyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Also Known As: BAS 02495979, Methyl 2-(4-chlorobenzamido)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate, methyl 2-[(4-chlorobenzoyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate, methyl 2-[(4-chlorobenzoyl)amino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate, Methyl2-(4-chlorobenzamido)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
| Molecular Formula | C19H21ClN2O4S |
|---|---|
| Molecular Weight | 408.09 g/mol |
| LogP | 4.23082 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.09106 |
| Heavy Atoms | 27 |
| Complexity | 857.3398 |
Chemical Identifiers
| CAS Number | 335406-04-7 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)Cl)C(=O)OC)C |
Product Overview
BAS 02495979 (CAS 335406-04-7), with molecular formula C19H21ClN2O4S and molecular weight 408.09 g/mol. IUPAC: methyl 2-[(4-chlorobenzoyl)amino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate.
Chemical Property Profile of BAS 02495979
Property Insights of BAS 02495979
The XLogP value of 4.23082 indicates that BAS 02495979 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 BAS 02495979. Following Lipinski's Rule of Five, BAS 02495979 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 BAS 02495979?
The CAS number of BAS 02495979 is 335406-04-7.
What is the molecular formula of BAS 02495979?
The molecular formula of BAS 02495979 is C19H21ClN2O4S.
What is the molecular weight of BAS 02495979?
The molecular weight of BAS 02495979 is 408.09 g/mol.
Where can I buy BAS 02495979?
You can request a quote for BAS 02495979 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02495979?
Yes, KEHONG BIO provides custom synthesis services for BAS 02495979 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.