5-(3-bromophenyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(3-bromophenyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(3-bromophenyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 4670-0182 |
| Compound Name: | 5-(3-bromophenyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 296.19 |
| Molecular Formula: | C11 H10 Br N3 S |
| Smiles: | C=CCN1C(c2cccc(c2)[Br])=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.7216 |
| logD: | 2.4639 |
| logSw: | -4.1669 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.8347 |
| InChI Key: | IXKYFOJFVVHCED-UHFFFAOYSA-N |