AB00732426-01
TL;DR: AB00732426-01 (CAS 852685-41-7) is a chemical compound with molecular formula C20H19F3N2O6S and molecular weight 472.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate
Also Known As: AB00732426-01, {[4-(trifluoromethoxy)phenyl]carbamoyl}methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate, [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate, [4-(trifluoromethoxy)phenyl]carbamoylmethyl 2-[2-(4-methylphenyl)ethenylsulfonylamino]acetate
| Molecular Formula | C20H19F3N2O6S |
|---|---|
| Molecular Weight | 472.09 g/mol |
| LogP | 2.96562 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 472.09158 |
| Heavy Atoms | 32 |
| Complexity | 1066.009 |
Chemical Identifiers
| CAS Number | 852685-41-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C/S(=O)(=O)NCC(=O)OCC(=O)NC2=CC=C(C=C2)OC(F)(F)F |
Product Overview
AB00732426-01 (CAS 852685-41-7), with molecular formula C20H19F3N2O6S and molecular weight 472.09 g/mol. IUPAC: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate.
Chemical Property Profile of AB00732426-01
Property Insights of AB00732426-01
The XLogP value of 2.96562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00732426-01. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00732426-01. Following Lipinski's Rule of Five, AB00732426-01 has 2 hydrogen bond donor(s) and 6 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 AB00732426-01?
The CAS number of AB00732426-01 is 852685-41-7.
What is the molecular formula of AB00732426-01?
The molecular formula of AB00732426-01 is C20H19F3N2O6S.
What is the molecular weight of AB00732426-01?
The molecular weight of AB00732426-01 is 472.09 g/mol.
Where can I buy AB00732426-01?
You can request a quote for AB00732426-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00732426-01?
Yes, KEHONG BIO provides custom synthesis services for AB00732426-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.