3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-fluoro-2-methylphenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-fluoro-2-methylphenyl)propanamide
3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-fluoro-2-methylphenyl)propanamide
Compound characteristics
| Compound ID: | J021-0327 |
| Compound Name: | 3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-fluoro-2-methylphenyl)propanamide |
| Molecular Weight: | 446.89 |
| Molecular Formula: | C20 H16 Cl F N4 O3 S |
| Smiles: | Cc1cc(ccc1NC(CCc1nc(CSc2nc3cc(ccc3o2)[Cl])no1)=O)F |
| Stereo: | ACHIRAL |
| logP: | 4.3513 |
| logD: | 4.351 |
| logSw: | -4.4746 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.415 |
| InChI Key: | HHMYXSZOEWRPNY-UHFFFAOYSA-N |