BAS 02496047
TL;DR: BAS 02496047 (CAS 335406-48-9) is a chemical compound with molecular formula C23H18ClF3N2O5S and molecular weight 526.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]-2-[(2-methoxybenzoyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: BAS 02496047, Methyl 5-((2-chloro-5-(trifluoromethyl)phenyl)carbamoyl)-2-(2-methoxybenzamido)-4-methylthiophene-3-carboxylate, 5-(2-Chloro-5-trifluoromethyl-phenylcarbamoyl)-2-(2-methoxy-benzoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester, methyl 5-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]-2-[(2-methoxybenzoyl)amino]-4-methylthiophene-3-carboxylate, Methyl5-((2-chloro-5-(trifluoromethyl)phenyl)carbamoyl)-2-(2-methoxybenzamido)-4-methylthiophene-3-carboxylate
| Molecular Formula | C23H18ClF3N2O5S |
|---|---|
| Molecular Weight | 526.06 g/mol |
| LogP | 6.02852 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 526.0577 |
| Heavy Atoms | 35 |
| Complexity | 1306.7943 |
Chemical Identifiers
| CAS Number | 335406-48-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=CC=C2OC)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
BAS 02496047 (CAS 335406-48-9), with molecular formula C23H18ClF3N2O5S and molecular weight 526.06 g/mol. IUPAC: methyl 5-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]-2-[(2-methoxybenzoyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of BAS 02496047
Property Insights of BAS 02496047
The XLogP value of 6.02852 indicates that BAS 02496047 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 02496047. Following Lipinski's Rule of Five, BAS 02496047 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02496047?
The CAS number of BAS 02496047 is 335406-48-9.
What is the molecular formula of BAS 02496047?
The molecular formula of BAS 02496047 is C23H18ClF3N2O5S.
What is the molecular weight of BAS 02496047?
The molecular weight of BAS 02496047 is 526.06 g/mol.
Where can I buy BAS 02496047?
You can request a quote for BAS 02496047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02496047?
Yes, KEHONG BIO provides custom synthesis services for BAS 02496047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.