5,5'-(butane-1,4-diyl)bis[4-(4-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione]
Chemical Structure Depiction of
5,5'-(butane-1,4-diyl)bis[4-(4-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione]
5,5'-(butane-1,4-diyl)bis[4-(4-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione]
Compound characteristics
| Compound ID: | 8013-0463 |
| Compound Name: | 5,5'-(butane-1,4-diyl)bis[4-(4-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione] |
| Molecular Weight: | 477.44 |
| Molecular Formula: | C20 H18 Cl2 N6 S2 |
| Smiles: | C(CCC1=NNC(N1c1ccc(cc1)[Cl])=S)CC1=NNC(N1c1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 5.093 |
| logD: | 4.6914 |
| logSw: | -5.4964 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.692 |
| InChI Key: | FDYAQTZPDDVWDT-UHFFFAOYSA-N |