AB00723507-01
TL;DR: AB00723507-01 (CAS 474895-12-0) is a chemical compound with molecular formula C19H13ClF3N3O2 and molecular weight 407.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-acetamidophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Also Known As: AB00723507-01, (E)-3-(4-acetamidophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-acetamidophenyl)prop-2-enamide
| Molecular Formula | C19H13ClF3N3O2 |
|---|---|
| Molecular Weight | 407.06 g/mol |
| LogP | 4.86288 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.06485 |
| Heavy Atoms | 28 |
| Complexity | 977.39886 |
Chemical Identifiers
| CAS Number | 474895-12-0 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl |
Product Overview
AB00723507-01 (CAS 474895-12-0), with molecular formula C19H13ClF3N3O2 and molecular weight 407.06 g/mol. IUPAC: (E)-3-(4-acetamidophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide.
Chemical Property Profile of AB00723507-01
Property Insights of AB00723507-01
The XLogP value of 4.86288 indicates that AB00723507-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00723507-01. Following Lipinski's Rule of Five, AB00723507-01 has 2 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 AB00723507-01?
The CAS number of AB00723507-01 is 474895-12-0.
What is the molecular formula of AB00723507-01?
The molecular formula of AB00723507-01 is C19H13ClF3N3O2.
What is the molecular weight of AB00723507-01?
The molecular weight of AB00723507-01 is 407.06 g/mol.
Where can I buy AB00723507-01?
You can request a quote for AB00723507-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00723507-01?
Yes, KEHONG BIO provides custom synthesis services for AB00723507-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.