4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
TL;DR: 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 312501-74-9) is a chemical compound with molecular formula C15H19N3S and molecular weight 273.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyclohexyl-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: BIM-0008753.P001, 4-cyclohexyl-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione, 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione, A1902/0079870, 4-cyclohexyl-3-(2-methylphenyl)-1,2,4-triazoline-5-thione
| Molecular Formula | C15H19N3S |
|---|---|
| Molecular Weight | 273.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.12997 |
| Heavy Atoms | 19 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 312501-74-9 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NNC(=S)N2C3CCCCC3 |
| InChIKey | GPNAWSRBDFQIOA-UHFFFAOYSA-N |
Product Overview
4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 312501-74-9), with molecular formula C15H19N3S and molecular weight 273.13 g/mol. IUPAC: 4-cyclohexyl-3-(2-methylphenyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Property Insights of 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
The XLogP value of 3.8 indicates that 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.7 Ų, 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione has 1 hydrogen bond donor(s) and 2 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 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The CAS number of 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 312501-74-9.
What is the molecular formula of 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular formula of 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is C15H19N3S.
What is the molecular weight of 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
The molecular weight of 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is 273.13 g/mol.
Where can I buy 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
You can request a quote for 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-cyclohexyl-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.