4,5-diphenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4,5-diphenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
4,5-diphenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8017-3971 |
| Compound Name: | 4,5-diphenyl-2-[(3-phenylpyrrolidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 412.56 |
| Molecular Formula: | C25 H24 N4 S |
| Smiles: | C1CN(CC1c1ccccc1)CN1C(N(C(c2ccccc2)=N1)c1ccccc1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2794 |
| logD: | 4.4508 |
| logSw: | -5.6756 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.681 |
| InChI Key: | SIXDPQSPJIICJY-JOCHJYFZSA-N |