AB00714357-01
TL;DR: AB00714357-01 (CAS 499226-32-3) is a chemical compound with molecular formula C23H19N3O4S and molecular weight 433.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-benzyl-3-hydroxy-1-oxoisoquinolin-4-yl)methylideneamino]benzenesulfonamide
Also Known As: AB00714357-01, 4-[(2-benzyl-1,3-dioxoisoquinolin-4-ylidene)methylamino]benzenesulfonamide, 4-[[(E)-(2-benzyl-1,3-dioxoisoquinolin-4-ylidene)methyl]amino]benzenesulfonamide, 4-[[(Z)-(2-benzyl-1,3-dioxoisoquinolin-4-ylidene)methyl]amino]benzenesulfonamide, (Z)-4-(((2-benzyl-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene)methyl)amino)benzenesulfonamide
| Molecular Formula | C23H19N3O4S |
|---|---|
| Molecular Weight | 433.11 g/mol |
| LogP | 3.1534 |
| Topological Polar Surface Area | 114.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.10962 |
| Heavy Atoms | 31 |
| Complexity | 1442.4346 |
Chemical Identifiers
| CAS Number | 499226-32-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=C(C3=CC=CC=C3C2=O)C=NC4=CC=C(C=C4)S(=O)(=O)N)O |
Product Overview
AB00714357-01 (CAS 499226-32-3), with molecular formula C23H19N3O4S and molecular weight 433.11 g/mol. IUPAC: 4-[(2-benzyl-3-hydroxy-1-oxoisoquinolin-4-yl)methylideneamino]benzenesulfonamide.
Chemical Property Profile of AB00714357-01
Property Insights of AB00714357-01
The XLogP value of 3.1534 indicates that AB00714357-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.75 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00714357-01. Following Lipinski's Rule of Five, AB00714357-01 has 2 hydrogen bond donor(s) and 5 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 AB00714357-01?
The CAS number of AB00714357-01 is 499226-32-3.
What is the molecular formula of AB00714357-01?
The molecular formula of AB00714357-01 is C23H19N3O4S.
What is the molecular weight of AB00714357-01?
The molecular weight of AB00714357-01 is 433.11 g/mol.
Where can I buy AB00714357-01?
You can request a quote for AB00714357-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00714357-01?
Yes, KEHONG BIO provides custom synthesis services for AB00714357-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.