5-methyl-5-(3-methylbutyl)-2-phenyl-1,2,4-triazolidine-3-thione
Chemical Structure Depiction of
5-methyl-5-(3-methylbutyl)-2-phenyl-1,2,4-triazolidine-3-thione
5-methyl-5-(3-methylbutyl)-2-phenyl-1,2,4-triazolidine-3-thione
Compound characteristics
| Compound ID: | 4670-0342 |
| Compound Name: | 5-methyl-5-(3-methylbutyl)-2-phenyl-1,2,4-triazolidine-3-thione |
| Molecular Weight: | 263.4 |
| Molecular Formula: | C14 H21 N3 S |
| Smiles: | CC(C)CCC1(C)NC(N(c2ccccc2)N1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8882 |
| logD: | 3.8882 |
| logSw: | -4.0055 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 27.5912 |
| InChI Key: | GWVPEOQKJPRWLN-AWEZNQCLSA-N |