3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3,4-dimethylphenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3,4-dimethylphenyl)propanamide
3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3,4-dimethylphenyl)propanamide
Compound characteristics
| Compound ID: | J021-3198 |
| Compound Name: | 3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(3,4-dimethylphenyl)propanamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C21 H20 N4 O2 S2 |
| Smiles: | Cc1ccc(cc1C)NC(CCc1nc(CSc2nc3ccccc3s2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4184 |
| logD: | 5.4184 |
| logSw: | -5.2741 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.531 |
| InChI Key: | LLPZPKLMMUBUED-UHFFFAOYSA-N |