3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Compound characteristics
| Compound ID: | J021-2258 |
| Compound Name: | 3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[4-(trifluoromethyl)phenyl]propanamide |
| Molecular Weight: | 464.49 |
| Molecular Formula: | C20 H15 F3 N4 O2 S2 |
| Smiles: | C(Cc1nc(CSc2nc3ccccc3s2)no1)C(Nc1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3037 |
| logD: | 5.3037 |
| logSw: | -5.6786 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.531 |
| InChI Key: | XYASFXYWZIEBKC-UHFFFAOYSA-N |