5-methyl-5-(2-methylpropyl)-2-phenyl-1,2,4-triazolidine-3-thione
Chemical Structure Depiction of
5-methyl-5-(2-methylpropyl)-2-phenyl-1,2,4-triazolidine-3-thione
5-methyl-5-(2-methylpropyl)-2-phenyl-1,2,4-triazolidine-3-thione
Compound characteristics
| Compound ID: | 4670-0341 |
| Compound Name: | 5-methyl-5-(2-methylpropyl)-2-phenyl-1,2,4-triazolidine-3-thione |
| Molecular Weight: | 249.38 |
| Molecular Formula: | C13 H19 N3 S |
| Smiles: | CC(C)CC1(C)NC(N(c2ccccc2)N1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4768 |
| logD: | 3.4767 |
| logSw: | -3.6968 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 27.5912 |
| InChI Key: | WVCFFDMZHCQTJD-ZDUSSCGKSA-N |