AB00118803-01
TL;DR: AB00118803-01 (CAS 431978-83-5) is a chemical compound with molecular formula C21H19ClN2O6S2 and molecular weight 494.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(3-chloro-2-methylphenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Also Known As: AB00118803-01, N-[4-[(3-chloro-2-methylphenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide, N-{4-[(3-chloro-2-methylphenyl)sulfamoyl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
| Molecular Formula | C21H19ClN2O6S2 |
|---|---|
| Molecular Weight | 494.04 g/mol |
| LogP | 4.02122 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 494.0373 |
| Heavy Atoms | 32 |
| Complexity | 1373.8988 |
Chemical Identifiers
| CAS Number | 431978-83-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4 |
Product Overview
AB00118803-01 (CAS 431978-83-5), with molecular formula C21H19ClN2O6S2 and molecular weight 494.04 g/mol. IUPAC: N-[4-[(3-chloro-2-methylphenyl)sulfamoyl]phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide.
Chemical Property Profile of AB00118803-01
Property Insights of AB00118803-01
The XLogP value of 4.02122 indicates that AB00118803-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00118803-01. Following Lipinski's Rule of Five, AB00118803-01 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 AB00118803-01?
The CAS number of AB00118803-01 is 431978-83-5.
What is the molecular formula of AB00118803-01?
The molecular formula of AB00118803-01 is C21H19ClN2O6S2.
What is the molecular weight of AB00118803-01?
The molecular weight of AB00118803-01 is 494.04 g/mol.
Where can I buy AB00118803-01?
You can request a quote for AB00118803-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00118803-01?
Yes, KEHONG BIO provides custom synthesis services for AB00118803-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.