3-[(4-bromoanilino)methyl]-5-(pyridin-4-yl)-1,3,4-oxadiazole-2(3H)-thione
Chemical Structure Depiction of
3-[(4-bromoanilino)methyl]-5-(pyridin-4-yl)-1,3,4-oxadiazole-2(3H)-thione
3-[(4-bromoanilino)methyl]-5-(pyridin-4-yl)-1,3,4-oxadiazole-2(3H)-thione
Compound characteristics
| Compound ID: | 8016-2286 |
| Compound Name: | 3-[(4-bromoanilino)methyl]-5-(pyridin-4-yl)-1,3,4-oxadiazole-2(3H)-thione |
| Molecular Weight: | 363.23 |
| Molecular Formula: | C14 H11 Br N4 O S |
| Smiles: | C(Nc1ccc(cc1)[Br])N1C(OC(c2ccncc2)=N1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.3567 |
| logD: | 3.3558 |
| logSw: | -3.5451 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.777 |
| InChI Key: | ASXHQISRYAKGMZ-UHFFFAOYSA-N |