3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4-dimethylphenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4-dimethylphenyl)propanamide
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4-dimethylphenyl)propanamide
Compound characteristics
| Compound ID: | J021-3313 |
| Compound Name: | 3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2,4-dimethylphenyl)propanamide |
| Molecular Weight: | 441.94 |
| Molecular Formula: | C21 H20 Cl N5 O2 S |
| Smiles: | Cc1ccc(c(C)c1)NC(CCc1nc(CSc2nc3cc(ccc3[nH]2)[Cl])no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2476 |
| logD: | 4.151 |
| logSw: | -4.4683 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.765 |
| InChI Key: | KRBGBJWFQKSGDM-UHFFFAOYSA-N |