3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3-bromophenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3-bromophenyl)propanamide
3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3-bromophenyl)propanamide
Compound characteristics
| Compound ID: | J021-0361 |
| Compound Name: | 3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3-bromophenyl)propanamide |
| Molecular Weight: | 458.33 |
| Molecular Formula: | C19 H16 Br N5 O2 S |
| Smiles: | C(Cc1nc(CSc2nc3ccccc3[nH]2)no1)C(Nc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8933 |
| logD: | 3.7968 |
| logSw: | -4.1574 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.463 |
| InChI Key: | JQBRIHDTQKHCDX-UHFFFAOYSA-N |