1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-
TL;DR: 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- (CAS 89313-78-0) is a chemical compound with molecular formula C15H13NS and molecular weight 239.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)-3H-isoindole-1-thione
Also Known As: ML011 Analog, 2-(p-tolyl)isoindoline-1-thione, 2-(4-methylphenyl)-3H-isoindole-1-thione, 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-, 2-(4-methylphenyl)-1-isoindolinethione
| Molecular Formula | C15H13NS |
|---|---|
| Molecular Weight | 239.08 g/mol |
| LogP | 3.69072 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.07687 |
| Heavy Atoms | 17 |
| Complexity | 571.7306 |
Chemical Identifiers
| CAS Number | 89313-78-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CC3=CC=CC=C3C2=S |
Product Overview
1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- (CAS 89313-78-0), with molecular formula C15H13NS and molecular weight 239.08 g/mol. IUPAC: 2-(4-methylphenyl)-3H-isoindole-1-thione.
Chemical Property Profile of 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-
Property Insights of 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-
The XLogP value of 3.69072 indicates that 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- has 0 hydrogen bond donor(s) and 1 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 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-?
The CAS number of 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- is 89313-78-0.
What is the molecular formula of 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-?
The molecular formula of 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- is C15H13NS.
What is the molecular weight of 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-?
The molecular weight of 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- is 239.08 g/mol.
Where can I buy 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-?
You can request a quote for 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Isoindole-1-thione, 2,3-dihydro-2-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.