BAS 02496531
TL;DR: BAS 02496531 (CAS 335406-05-8) is a chemical compound with molecular formula C23H22N2O5S and molecular weight 438.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(3-methoxyphenyl)carbamoyl]-4-methyl-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylate
Also Known As: BAS 02496531, Methyl 5-((3-methoxyphenyl)carbamoyl)-4-methyl-2-(3-methylbenzamido)thiophene-3-carboxylate, Methyl5-((3-methoxyphenyl)carbamoyl)-4-methyl-2-(3-methylbenzamido)thiophene-3-carboxylate, 5-(3-Methoxy-phenylcarbamoyl)-4-methyl-2-(3-methyl-benzoylamino)-thiophene-3-carboxylic acid methyl ester, methyl 5-[(3-methoxyphenyl)carbamoyl]-4-methyl-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylate
| Molecular Formula | C23H22N2O5S |
|---|---|
| Molecular Weight | 438.12 g/mol |
| LogP | 4.66474 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.12494 |
| Heavy Atoms | 31 |
| Complexity | 1152.6187 |
Chemical Identifiers
| CAS Number | 335406-05-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC2=C(C(=C(S2)C(=O)NC3=CC(=CC=C3)OC)C)C(=O)OC |
Product Overview
BAS 02496531 (CAS 335406-05-8), with molecular formula C23H22N2O5S and molecular weight 438.12 g/mol. IUPAC: methyl 5-[(3-methoxyphenyl)carbamoyl]-4-methyl-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of BAS 02496531
Property Insights of BAS 02496531
The XLogP value of 4.66474 indicates that BAS 02496531 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02496531. Following Lipinski's Rule of Five, BAS 02496531 has 2 hydrogen bond donor(s) and 6 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 02496531?
The CAS number of BAS 02496531 is 335406-05-8.
What is the molecular formula of BAS 02496531?
The molecular formula of BAS 02496531 is C23H22N2O5S.
What is the molecular weight of BAS 02496531?
The molecular weight of BAS 02496531 is 438.12 g/mol.
Where can I buy BAS 02496531?
You can request a quote for BAS 02496531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02496531?
Yes, KEHONG BIO provides custom synthesis services for BAS 02496531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.