1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline
TL;DR: 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline (CAS 301332-59-2) is a chemical compound with molecular formula C25H20N2O2S and molecular weight 412.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-indol-3-yl)-2-(2-phenylethenylsulfonyl)-1H-isoquinoline
Also Known As: ChemDiv3_000086, 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline, 1-(1H-indol-3-yl)-2-(2-phenylethenylsulfonyl)-1H-isoquinoline, 1-(1H-indol-3-yl)-2-[(2-phenylvinyl)sulfonyl]-1,2-dihydroisoquinoline
| Molecular Formula | C25H20N2O2S |
|---|---|
| Molecular Weight | 412.12 g/mol |
| LogP | 5.5443 |
| Topological Polar Surface Area | 53.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.12454 |
| Heavy Atoms | 30 |
| Complexity | 1368.568 |
Chemical Identifiers
| CAS Number | 301332-59-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CS(=O)(=O)N2C=CC3=CC=CC=C3C2C4=CNC5=CC=CC=C54 |
Product Overview
1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline (CAS 301332-59-2), with molecular formula C25H20N2O2S and molecular weight 412.12 g/mol. IUPAC: 1-(1H-indol-3-yl)-2-(2-phenylethenylsulfonyl)-1H-isoquinoline.
Chemical Property Profile of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline
Property Insights of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline
The XLogP value of 5.5443 indicates that 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.17 Ų, 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline?
The CAS number of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline is 301332-59-2.
What is the molecular formula of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline?
The molecular formula of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline is C25H20N2O2S.
What is the molecular weight of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline?
The molecular weight of 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline is 412.12 g/mol.
Where can I buy 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline?
You can request a quote for 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-indol-3-yl)-2-(styrylsulfonyl)-1,2-dihydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.