2-(3,4-dimethylphenyl)-5,5-dimethyl-1,2,4-triazolidine-3-thione
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5,5-dimethyl-1,2,4-triazolidine-3-thione
2-(3,4-dimethylphenyl)-5,5-dimethyl-1,2,4-triazolidine-3-thione
Compound characteristics
| Compound ID: | 8015-5593 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5,5-dimethyl-1,2,4-triazolidine-3-thione |
| Molecular Weight: | 235.35 |
| Molecular Formula: | C12 H17 N3 S |
| Smiles: | Cc1ccc(cc1C)N1C(NC(C)(C)N1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.5233 |
| logD: | 3.5215 |
| logSw: | -3.6768 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 26.3773 |
| InChI Key: | FOSKZVPFYBOAMF-UHFFFAOYSA-N |