4-methyl-5-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-methyl-5-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-methyl-5-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8008-3100 |
| Compound Name: | 4-methyl-5-phenyl-2-[(pyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 274.39 |
| Molecular Formula: | C14 H18 N4 S |
| Smiles: | CN1C(c2ccccc2)=NN(CN2CCCC2)C1=S |
| Stereo: | ACHIRAL |
| logP: | 2.3745 |
| logD: | -0.6166 |
| logSw: | -2.2682 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.6678 |
| InChI Key: | LFEBLRSMOVOMFU-UHFFFAOYSA-N |