A4116/0175483
TL;DR: A4116/0175483 (CAS 893775-16-1) is a chemical compound with molecular formula C19H21N3O4S2 and molecular weight 419.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyl-2,3-dioxo-N-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)quinoxaline-6-sulfonamide
Also Known As: A4116/0175483, 1,4-dimethyl-2,3-dioxo-N-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)quinoxaline-6-sulfonamide, 1,4-dimethyl-2,3-dioxo-N-(4,5,6,7-tetrahydro-1-benzothien-3-ylmethyl)-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide, 1,4-DIMETHYL-2,3-DIOXO-N-(4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-3-YLMETHYL)-1,2,3,4-TETRAHYDRO-6-QUINOXALINESULFONAMIDE, 1,4-dimethyl-2,3-dioxo-N-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
| Molecular Formula | C19H21N3O4S2 |
|---|---|
| Molecular Weight | 419.10 g/mol |
| LogP | 1.656 |
| Topological Polar Surface Area | 90.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.09735 |
| Heavy Atoms | 28 |
| Complexity | 1299.1855 |
Chemical Identifiers
| CAS Number | 893775-16-1 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)S(=O)(=O)NCC3=CSC4=C3CCCC4)N(C(=O)C1=O)C |
Product Overview
A4116/0175483 (CAS 893775-16-1), with molecular formula C19H21N3O4S2 and molecular weight 419.10 g/mol. IUPAC: 1,4-dimethyl-2,3-dioxo-N-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)quinoxaline-6-sulfonamide.
Chemical Property Profile of A4116/0175483
Property Insights of A4116/0175483
The XLogP value of 1.656 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A4116/0175483. The TPSA of 90.17 Ų falls within the moderate polarity range, balancing permeability and solubility for A4116/0175483. Following Lipinski's Rule of Five, A4116/0175483 has 1 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 A4116/0175483?
The CAS number of A4116/0175483 is 893775-16-1.
What is the molecular formula of A4116/0175483?
The molecular formula of A4116/0175483 is C19H21N3O4S2.
What is the molecular weight of A4116/0175483?
The molecular weight of A4116/0175483 is 419.10 g/mol.
Where can I buy A4116/0175483?
You can request a quote for A4116/0175483 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4116/0175483?
Yes, KEHONG BIO provides custom synthesis services for A4116/0175483 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.