5-butyl-2-(2,3-dimethylphenyl)-5-methyl-1,2,4-triazolidine-3-thione
Chemical Structure Depiction of
5-butyl-2-(2,3-dimethylphenyl)-5-methyl-1,2,4-triazolidine-3-thione
5-butyl-2-(2,3-dimethylphenyl)-5-methyl-1,2,4-triazolidine-3-thione
Compound characteristics
| Compound ID: | 8011-1072 |
| Compound Name: | 5-butyl-2-(2,3-dimethylphenyl)-5-methyl-1,2,4-triazolidine-3-thione |
| Molecular Weight: | 277.43 |
| Molecular Formula: | C15 H23 N3 S |
| Smiles: | CCCCC1(C)NC(N(c2cccc(C)c2C)N1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6644 |
| logD: | 4.6644 |
| logSw: | -4.3292 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 27.2903 |
| InChI Key: | DPCAHBQSYYVNLK-HNNXBMFYSA-N |