5-hexyl-5-methyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione
Chemical Structure Depiction of
5-hexyl-5-methyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione
5-hexyl-5-methyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione
Compound characteristics
| Compound ID: | 8009-0834 |
| Compound Name: | 5-hexyl-5-methyl-2-(4-methylphenyl)-1,2,4-triazolidine-3-thione |
| Molecular Weight: | 291.46 |
| Molecular Formula: | C16 H25 N3 S |
| Smiles: | CCCCCCC1(C)NC(N(c2ccc(C)cc2)N1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2025 |
| logD: | 5.2025 |
| logSw: | -4.99 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 27.5912 |
| InChI Key: | AOVSBDMUJYLOMN-INIZCTEOSA-N |