3-Phenyl-2-propyl-1-isoindolinethione
TL;DR: 3-Phenyl-2-propyl-1-isoindolinethione (CAS 123217-57-2) is a chemical compound with molecular formula C17H17NS and molecular weight 267.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-2-propyl-3H-isoindole-1-thione
Also Known As: 3-phenyl-2-propyl-1-isoindolinethione, 3-phenyl-2-propyl-3H-isoindole-1-thione, AO-435/41051499
| Molecular Formula | C17H17NS |
|---|---|
| Molecular Weight | 267.11 g/mol |
| LogP | 4.1771 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.1082 |
| Heavy Atoms | 19 |
| Complexity | 591.2209 |
Chemical Identifiers
| CAS Number | 123217-57-2 |
|---|---|
| SMILES | CCCN1C(C2=CC=CC=C2C1=S)C3=CC=CC=C3 |
Product Overview
3-Phenyl-2-propyl-1-isoindolinethione (CAS 123217-57-2), with molecular formula C17H17NS and molecular weight 267.11 g/mol. IUPAC: 3-phenyl-2-propyl-3H-isoindole-1-thione.
Chemical Property Profile of 3-Phenyl-2-propyl-1-isoindolinethione
Property Insights of 3-Phenyl-2-propyl-1-isoindolinethione
The XLogP value of 4.1771 indicates that 3-Phenyl-2-propyl-1-isoindolinethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 3-Phenyl-2-propyl-1-isoindolinethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-2-propyl-1-isoindolinethione 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 3-Phenyl-2-propyl-1-isoindolinethione?
The CAS number of 3-Phenyl-2-propyl-1-isoindolinethione is 123217-57-2.
What is the molecular formula of 3-Phenyl-2-propyl-1-isoindolinethione?
The molecular formula of 3-Phenyl-2-propyl-1-isoindolinethione is C17H17NS.
What is the molecular weight of 3-Phenyl-2-propyl-1-isoindolinethione?
The molecular weight of 3-Phenyl-2-propyl-1-isoindolinethione is 267.11 g/mol.
Where can I buy 3-Phenyl-2-propyl-1-isoindolinethione?
You can request a quote for 3-Phenyl-2-propyl-1-isoindolinethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-2-propyl-1-isoindolinethione?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-2-propyl-1-isoindolinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.