AB00742262-01
TL;DR: AB00742262-01 (CAS 386279-36-3) is a chemical compound with molecular formula C15H9Cl2F3N2O3 and molecular weight 391.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl] 6-chloropyridine-3-carboxylate
Also Known As: AB00742262-01, [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl] 6-chloropyridine-3-carboxylate, {[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}methyl 6-chloropyridine-3-carboxylate
| Molecular Formula | C15H9Cl2F3N2O3 |
|---|---|
| Molecular Weight | 391.99 g/mol |
| LogP | 4.2027 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.99423 |
| Heavy Atoms | 25 |
| Complexity | 795.5989 |
Chemical Identifiers
| CAS Number | 386279-36-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)COC(=O)C2=CN=C(C=C2)Cl)C(F)(F)F)Cl |
Product Overview
AB00742262-01 (CAS 386279-36-3), with molecular formula C15H9Cl2F3N2O3 and molecular weight 391.99 g/mol. IUPAC: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl] 6-chloropyridine-3-carboxylate.
Chemical Property Profile of AB00742262-01
Property Insights of AB00742262-01
The XLogP value of 4.2027 indicates that AB00742262-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00742262-01. Following Lipinski's Rule of Five, AB00742262-01 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 AB00742262-01?
The CAS number of AB00742262-01 is 386279-36-3.
What is the molecular formula of AB00742262-01?
The molecular formula of AB00742262-01 is C15H9Cl2F3N2O3.
What is the molecular weight of AB00742262-01?
The molecular weight of AB00742262-01 is 391.99 g/mol.
Where can I buy AB00742262-01?
You can request a quote for AB00742262-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00742262-01?
Yes, KEHONG BIO provides custom synthesis services for AB00742262-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.