AB00114287-01
TL;DR: AB00114287-01 (CAS 431066-08-9) is a chemical compound with molecular formula C22H25F3N2O3S and molecular weight 454.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[cyclohexyl-(4-methylphenyl)sulfonylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: AB00114287-01, 2-[cyclohexyl-(4-methylphenyl)sulfonylamino]-N-[2-(trifluoromethyl)phenyl]acetamide, N~2~-cyclohexyl-N~2~-[(4-methylphenyl)sulfonyl]-N-[2-(trifluoromethyl)phenyl]glycinamide
| Molecular Formula | C22H25F3N2O3S |
|---|---|
| Molecular Weight | 454.15 g/mol |
| LogP | 4.97592 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.1538 |
| Heavy Atoms | 31 |
| Complexity | 1015.0418 |
Chemical Identifiers
| CAS Number | 431066-08-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(F)(F)F)C3CCCCC3 |
Product Overview
AB00114287-01 (CAS 431066-08-9), with molecular formula C22H25F3N2O3S and molecular weight 454.15 g/mol. IUPAC: 2-[cyclohexyl-(4-methylphenyl)sulfonylamino]-N-[2-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of AB00114287-01
Property Insights of AB00114287-01
The XLogP value of 4.97592 indicates that AB00114287-01 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 AB00114287-01. Following Lipinski's Rule of Five, AB00114287-01 has 1 hydrogen bond donor(s) and 3 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 AB00114287-01?
The CAS number of AB00114287-01 is 431066-08-9.
What is the molecular formula of AB00114287-01?
The molecular formula of AB00114287-01 is C22H25F3N2O3S.
What is the molecular weight of AB00114287-01?
The molecular weight of AB00114287-01 is 454.15 g/mol.
Where can I buy AB00114287-01?
You can request a quote for AB00114287-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00114287-01?
Yes, KEHONG BIO provides custom synthesis services for AB00114287-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.