6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
TL;DR: 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CAS 110010-92-9) is a chemical compound with molecular formula C17H19NO4S and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
Also Known As: Maybridge2_000712, MixCom4_000015, IDI1_001759, 6,7-dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline, 2-(benzenesulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
| Molecular Formula | C17H19NO4S |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.1035 |
| Heavy Atoms | 23 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 110010-92-9 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=CC=C3)OC |
| InChIKey | CSNIEDVDIPSJNF-UHFFFAOYSA-N |
Product Overview
6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CAS 110010-92-9), with molecular formula C17H19NO4S and molecular weight 333.10 g/mol. IUPAC: 2-(benzenesulfonyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline.
Chemical Property Profile of 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Property Insights of 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline. Following Lipinski's Rule of Five, 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline has 0 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 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline is 110010-92-9.
What is the molecular formula of 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline is C17H19NO4S.
What is the molecular weight of 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline is 333.10 g/mol.
Where can I buy 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dimethoxy-2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.