3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione
TL;DR: 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione (CAS 63224-33-9) is a chemical compound with molecular formula C9H9N3OS and molecular weight 207.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxyphenyl)-4-methyl-1H-1,2,4-triazole-5-thione
Also Known As: triazolinethione, 2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)phenol, triazolinethione HMT, Maybridge1_005737, DivK1c_002025
| Molecular Formula | C9H9N3OS |
|---|---|
| Molecular Weight | 207.05 g/mol |
| LogP | 1.85029 |
| Topological Polar Surface Area | 53.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.04663 |
| Heavy Atoms | 14 |
| Complexity | 514.77075 |
Chemical Identifiers
| CAS Number | 63224-33-9 |
|---|---|
| SMILES | CN1C(=NNC1=S)C2=CC=CC=C2O |
Product Overview
3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione (CAS 63224-33-9), with molecular formula C9H9N3OS and molecular weight 207.05 g/mol. IUPAC: 3-(2-hydroxyphenyl)-4-methyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione
Property Insights of 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione
The XLogP value of 1.85029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione. With a topological polar surface area (TPSA) of 53.84 Ų, 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione has 2 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 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione?
The CAS number of 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione is 63224-33-9.
What is the molecular formula of 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione?
The molecular formula of 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione is C9H9N3OS.
What is the molecular weight of 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione?
The molecular weight of 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione is 207.05 g/mol.
Where can I buy 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione?
You can request a quote for 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Hydroxyphenyl)-4-methyl-1,2,4-delta-2-triazoline-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.