BAS 02496621
TL;DR: BAS 02496621 (CAS 335406-29-6) is a chemical compound with molecular formula C24H23ClN2O7S and molecular weight 518.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate
Also Known As: BAS 02496621, Methyl 5-((3-chlorophenyl)carbamoyl)-4-methyl-2-(3,4,5-trimethoxybenzamido)thiophene-3-carboxylate, 5-(3-Chloro-phenylcarbamoyl)-4-methyl-2-(3,4,5-trimethoxy-benzoylamino)-thiophene-3-carboxylic acid methyl ester, methyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate, Methyl5-((3-chlorophenyl)carbamoyl)-4-methyl-2-(3,4,5-trimethoxybenzamido)thiophene-3-carboxylate
| Molecular Formula | C24H23ClN2O7S |
|---|---|
| Molecular Weight | 518.09 g/mol |
| LogP | 5.02692 |
| Topological Polar Surface Area | 112.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 518.09143 |
| Heavy Atoms | 35 |
| Complexity | 1263.8673 |
Chemical Identifiers
| CAS Number | 335406-29-6 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)NC3=CC(=CC=C3)Cl |
Product Overview
BAS 02496621 (CAS 335406-29-6), with molecular formula C24H23ClN2O7S and molecular weight 518.09 g/mol. IUPAC: methyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of BAS 02496621
Property Insights of BAS 02496621
The XLogP value of 5.02692 indicates that BAS 02496621 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02496621. Following Lipinski's Rule of Five, BAS 02496621 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02496621?
The CAS number of BAS 02496621 is 335406-29-6.
What is the molecular formula of BAS 02496621?
The molecular formula of BAS 02496621 is C24H23ClN2O7S.
What is the molecular weight of BAS 02496621?
The molecular weight of BAS 02496621 is 518.09 g/mol.
Where can I buy BAS 02496621?
You can request a quote for BAS 02496621 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02496621?
Yes, KEHONG BIO provides custom synthesis services for BAS 02496621 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.