AB00108697-01
TL;DR: AB00108697-01 (CAS 428488-25-9) is a chemical compound with molecular formula C23H21F3N2O3S and molecular weight 462.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: AB00108697-01, 2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-[2-(trifluoromethyl)phenyl]acetamide, N~2~-(3,4-dimethylphenyl)-N~2~-(phenylsulfonyl)-N-[2-(trifluoromethyl)phenyl]glycinamide, 2-[N-(3,4-DIMETHYLPHENYL)BENZENESULFONAMIDO]-N-[2-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
| Molecular Formula | C23H21F3N2O3S |
|---|---|
| Molecular Weight | 462.12 g/mol |
| LogP | 5.15624 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.1225 |
| Heavy Atoms | 32 |
| Complexity | 1226.734 |
Chemical Identifiers
| CAS Number | 428488-25-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CC=CC=C3)C |
Product Overview
AB00108697-01 (CAS 428488-25-9), with molecular formula C23H21F3N2O3S and molecular weight 462.12 g/mol. IUPAC: 2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-[2-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of AB00108697-01
Property Insights of AB00108697-01
The XLogP value of 5.15624 indicates that AB00108697-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00108697-01. Following Lipinski's Rule of Five, AB00108697-01 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00108697-01?
The CAS number of AB00108697-01 is 428488-25-9.
What is the molecular formula of AB00108697-01?
The molecular formula of AB00108697-01 is C23H21F3N2O3S.
What is the molecular weight of AB00108697-01?
The molecular weight of AB00108697-01 is 462.12 g/mol.
Where can I buy AB00108697-01?
You can request a quote for AB00108697-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00108697-01?
Yes, KEHONG BIO provides custom synthesis services for AB00108697-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.