2-(anilinomethyl)-4-ethyl-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
2-(anilinomethyl)-4-ethyl-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
2-(anilinomethyl)-4-ethyl-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8008-4502 |
| Compound Name: | 2-(anilinomethyl)-4-ethyl-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 310.42 |
| Molecular Formula: | C17 H18 N4 S |
| Smiles: | CCN1C(c2ccccc2)=NN(CNc2ccccc2)C1=S |
| Stereo: | ACHIRAL |
| logP: | 3.7645 |
| logD: | 3.7615 |
| logSw: | -3.9986 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.9944 |
| InChI Key: | PUTKZEUQMUHPQL-UHFFFAOYSA-N |