N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide
TL;DR: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide (CAS 1008948-07-9) is a chemical compound with molecular formula C19H22N2O3S and molecular weight 358.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide
Also Known As: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide, N-[1-(3,4-dihydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide
| Molecular Formula | C19H22N2O3S |
|---|---|
| Molecular Weight | 358.14 g/mol |
| LogP | 2.24672 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.1351 |
| Heavy Atoms | 25 |
| Complexity | 875.7971 |
Chemical Identifiers
| CAS Number | 1008948-07-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)N2CCC3=CC=CC=C3C2 |
Product Overview
N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide (CAS 1008948-07-9), with molecular formula C19H22N2O3S and molecular weight 358.14 g/mol. IUPAC: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide.
Chemical Property Profile of N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide
Property Insights of N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide
The XLogP value of 2.24672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide has 1 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 N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide?
The CAS number of N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide is 1008948-07-9.
What is the molecular formula of N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide?
The molecular formula of N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide is C19H22N2O3S.
What is the molecular weight of N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide?
The molecular weight of N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide is 358.14 g/mol.
Where can I buy N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide?
You can request a quote for N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.