![3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole structure](/static/products/7063/7063-03-8.webp)
3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole
TL;DR: 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole (CAS 7063-03-8) is a chemical compound with molecular formula C18H17N3O2S2 and molecular weight 371.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole
Also Known As: 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole, 2-(3-Methylbenzene-1-sulfonyl)-1-(1,2,5-thiadiazol-3-yl)-1,2,3,4-tetrahydroisoquinoline, 2-(3-methylphenyl)sulfonyl-1-(1,2,5-thiadiazol-3-yl)-3,4-dihydro-1H-isoquinoline
| Molecular Formula | C18H17N3O2S2 |
|---|---|
| Molecular Weight | 371.08 g/mol |
| LogP | 3.18292 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.07623 |
| Heavy Atoms | 25 |
| Complexity | 1000.67535 |
Chemical Identifiers
| CAS Number | 7063-03-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2C4=NSN=C4 |
Product Overview
3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole (CAS 7063-03-8), with molecular formula C18H17N3O2S2 and molecular weight 371.08 g/mol. IUPAC: 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole.
Chemical Property Profile of 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole
Property Insights of 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole
The XLogP value of 3.18292 indicates that 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole. Following Lipinski's Rule of Five, 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole 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 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole?
The CAS number of 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole is 7063-03-8.
What is the molecular formula of 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole?
The molecular formula of 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole is C18H17N3O2S2.
What is the molecular weight of 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole?
The molecular weight of 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole is 371.08 g/mol.
Where can I buy 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole?
You can request a quote for 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(3-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]-1,2,5-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.