Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-
TL;DR: Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- (CAS 57742-25-3) is a chemical compound with molecular formula C16H16N2O3S and molecular weight 316.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(3-oxo-1,4-dihydroisoquinolin-2-yl)benzenesulfonamide
Also Known As: n-methyl-n-(3-oxo-3,4-dihydroisoquinolin-2(1h)-yl)benzenesulfonamide, Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-, N-Methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)benzenesulfonamide, Benzenesulfonamide, N-(3,4-dihydro-3-oxo-2(1H)-isoquinolinyl)-N-methyl-, N-methyl-N-(3-oxo-1,4-dihydroisoquinolin-2-yl)benzenesulfonamide
| Molecular Formula | C16H16N2O3S |
|---|---|
| Molecular Weight | 316.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.08817 |
| Heavy Atoms | 22 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 57742-25-3 |
|---|---|
| SMILES | CN(N1CC2=CC=CC=C2CC1=O)S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | WCCDYGDLNHGPLT-UHFFFAOYSA-N |
Product Overview
Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- (CAS 57742-25-3), with molecular formula C16H16N2O3S and molecular weight 316.09 g/mol. IUPAC: N-methyl-N-(3-oxo-1,4-dihydroisoquinolin-2-yl)benzenesulfonamide.
Chemical Property Profile of Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-
Property Insights of Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-. Following Lipinski's Rule of Five, Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- has 0 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 Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-?
The CAS number of Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- is 57742-25-3.
What is the molecular formula of Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-?
The molecular formula of Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- is C16H16N2O3S.
What is the molecular weight of Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-?
The molecular weight of Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- is 316.09 g/mol.
Where can I buy Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-?
You can request a quote for Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonamide, N-methyl-N-(3-oxo-1,2,3,4-tetrahydroisoquinolin-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.