3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Compound characteristics
| Compound ID: | J021-3352 |
| Compound Name: | 3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide |
| Molecular Weight: | 481.88 |
| Molecular Formula: | C20 H15 Cl F3 N5 O2 S |
| Smiles: | C(Cc1nc(CSc2nc3cc(ccc3[nH]2)[Cl])no1)C(Nc1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6377 |
| logD: | 4.5412 |
| logSw: | -4.8768 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.463 |
| InChI Key: | ABNXYYMMTBSXPX-UHFFFAOYSA-N |