3-[(2-bromoanilino)methyl]-5-(2-chlorophenyl)-1,3,4-oxadiazole-2(3H)-thione
Chemical Structure Depiction of
3-[(2-bromoanilino)methyl]-5-(2-chlorophenyl)-1,3,4-oxadiazole-2(3H)-thione
3-[(2-bromoanilino)methyl]-5-(2-chlorophenyl)-1,3,4-oxadiazole-2(3H)-thione
Compound characteristics
| Compound ID: | 2141-0197 |
| Compound Name: | 3-[(2-bromoanilino)methyl]-5-(2-chlorophenyl)-1,3,4-oxadiazole-2(3H)-thione |
| Molecular Weight: | 396.69 |
| Molecular Formula: | C15 H11 Br Cl N3 O S |
| Smiles: | C(Nc1ccccc1[Br])N1C(OC(c2ccccc2[Cl])=N1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.6308 |
| logD: | 4.6308 |
| logSw: | -4.8747 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.651 |
| InChI Key: | KMHOJBHPXFWAPY-UHFFFAOYSA-N |