ChemDiv1_007123
TL;DR: ChemDiv1_007123 (CAS 6401-23-6) is a chemical compound with molecular formula C22H19ClF3N3O3S and molecular weight 497.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-chloro-N-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)anilino]-N-(pyridin-4-ylmethyl)acetamide
Also Known As: ChemDiv1_007123, AB01306313-01, N~2~-[4-chloro-3-(trifluoromethyl)phenyl]-N~2~-[(4-methylphenyl)sulfonyl]-N-(pyridin-4-ylmethyl)glycinamide, 2-[4-chloro-N-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)anilino]-N-(pyridin-4-ylmethyl)acetamide, 2-{N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]4-METHYLBENZENESULFONAMIDO}-N-[(PYRIDIN-4-YL)METHYL]ACETAMIDE
| Molecular Formula | C22H19ClF3N3O3S |
|---|---|
| Molecular Weight | 497.08 g/mol |
| LogP | 4.57392 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.07877 |
| Heavy Atoms | 33 |
| Complexity | 1235.2361 |
Chemical Identifiers
| CAS Number | 6401-23-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=NC=C2)C3=CC(=C(C=C3)Cl)C(F)(F)F |
Product Overview
ChemDiv1_007123 (CAS 6401-23-6), with molecular formula C22H19ClF3N3O3S and molecular weight 497.08 g/mol. IUPAC: 2-[4-chloro-N-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)anilino]-N-(pyridin-4-ylmethyl)acetamide.
Chemical Property Profile of ChemDiv1_007123
Property Insights of ChemDiv1_007123
The XLogP value of 4.57392 indicates that ChemDiv1_007123 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_007123. Following Lipinski's Rule of Five, ChemDiv1_007123 has 1 hydrogen bond donor(s) and 4 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 ChemDiv1_007123?
The CAS number of ChemDiv1_007123 is 6401-23-6.
What is the molecular formula of ChemDiv1_007123?
The molecular formula of ChemDiv1_007123 is C22H19ClF3N3O3S.
What is the molecular weight of ChemDiv1_007123?
The molecular weight of ChemDiv1_007123 is 497.08 g/mol.
Where can I buy ChemDiv1_007123?
You can request a quote for ChemDiv1_007123 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007123?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007123 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.