3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-bromo-3-methylphenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-bromo-3-methylphenyl)propanamide
3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-bromo-3-methylphenyl)propanamide
Compound characteristics
| Compound ID: | J021-0356 |
| Compound Name: | 3-(3-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-bromo-3-methylphenyl)propanamide |
| Molecular Weight: | 472.36 |
| Molecular Formula: | C20 H18 Br N5 O2 S |
| Smiles: | Cc1cc(ccc1[Br])NC(CCc1nc(CSc2nc3ccccc3[nH]2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2598 |
| logD: | 4.1633 |
| logSw: | -4.2739 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.463 |
| InChI Key: | RQSLWJONALCUBD-UHFFFAOYSA-N |