2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline
TL;DR: 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline (CAS 900340-77-4) is a chemical compound with molecular formula C14H14N2O2S and molecular weight 274.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline
Also Known As: 2-(pyridine-3-sulfonyl)-1,2,3,4-tetrahydroisoquinoline, 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline
| Molecular Formula | C14H14N2O2S |
|---|---|
| Molecular Weight | 274.08 g/mol |
| LogP | 1.8286 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.0776 |
| Heavy Atoms | 19 |
| Complexity | 683.602 |
Chemical Identifiers
| CAS Number | 900340-77-4 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CN=CC=C3 |
Product Overview
2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline (CAS 900340-77-4), with molecular formula C14H14N2O2S and molecular weight 274.08 g/mol. IUPAC: 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline.
Chemical Property Profile of 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline
Property Insights of 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline
The XLogP value of 1.8286 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline. With a topological polar surface area (TPSA) of 50.27 Ų, 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline has 0 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 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline?
The CAS number of 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline is 900340-77-4.
What is the molecular formula of 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline?
The molecular formula of 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline is C14H14N2O2S.
What is the molecular weight of 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline?
The molecular weight of 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline is 274.08 g/mol.
Where can I buy 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline?
You can request a quote for 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-pyridin-3-ylsulfonyl-3,4-dihydro-1H-isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.