N-{[3-(3-chloro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-{[3-(3-chloro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,3-dimethylbutanamide
N-{[3-(3-chloro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V030-5467 |
| Compound Name: | N-{[3-(3-chloro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,3-dimethylbutanamide |
| Molecular Weight: | 321.8 |
| Molecular Formula: | C16 H20 Cl N3 O2 |
| Smiles: | Cc1ccc(cc1[Cl])c1nc(CNC(CC(C)(C)C)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.8096 |
| logD: | 4.8096 |
| logSw: | -4.8948 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.053 |
| InChI Key: | VFMBDBSQQFNDOM-UHFFFAOYSA-N |