N-(3-acetylphenyl)-3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(3-acetylphenyl)-3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
| Compound ID: | J021-3329 |
| Compound Name: | N-(3-acetylphenyl)-3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
| Molecular Weight: | 455.92 |
| Molecular Formula: | C21 H18 Cl N5 O3 S |
| Smiles: | CC(c1cccc(c1)NC(CCc1nc(CSc2nc3cc(ccc3[nH]2)[Cl])no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5059 |
| logD: | 3.4093 |
| logSw: | -4.0165 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.29 |
| InChI Key: | ZIBWVLGKISLTFN-UHFFFAOYSA-N |