BAS 06970682
TL;DR: BAS 06970682 (CAS 1008935-77-0) is a chemical compound with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Also Known As: BAS 06970682, 2-(3,4-dimethoxybenzenesulfonyl)-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide, 2-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide, 2-(3,4-Dimethoxy-benzenesulfonyl)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid methylamide
| Molecular Formula | C19H22N2O5S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 1.5654 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.12494 |
| Heavy Atoms | 27 |
| Complexity | 958.3224 |
Chemical Identifiers
| CAS Number | 1008935-77-0 |
|---|---|
| SMILES | CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
BAS 06970682 (CAS 1008935-77-0), with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide.
Chemical Property Profile of BAS 06970682
Property Insights of BAS 06970682
The XLogP value of 1.5654 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06970682. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06970682. Following Lipinski's Rule of Five, BAS 06970682 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 BAS 06970682?
The CAS number of BAS 06970682 is 1008935-77-0.
What is the molecular formula of BAS 06970682?
The molecular formula of BAS 06970682 is C19H22N2O5S.
What is the molecular weight of BAS 06970682?
The molecular weight of BAS 06970682 is 390.12 g/mol.
Where can I buy BAS 06970682?
You can request a quote for BAS 06970682 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06970682?
Yes, KEHONG BIO provides custom synthesis services for BAS 06970682 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.