4-(3,3-dimethylbutanoyl)-1-(3-fluoro-4-methylphenyl)-3-methylpiperazin-2-one
Chemical Structure Depiction of
4-(3,3-dimethylbutanoyl)-1-(3-fluoro-4-methylphenyl)-3-methylpiperazin-2-one
4-(3,3-dimethylbutanoyl)-1-(3-fluoro-4-methylphenyl)-3-methylpiperazin-2-one
Compound characteristics
| Compound ID: | V009-5964 |
| Compound Name: | 4-(3,3-dimethylbutanoyl)-1-(3-fluoro-4-methylphenyl)-3-methylpiperazin-2-one |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C18 H25 F N2 O2 |
| Smiles: | CC1C(N(CCN1C(CC(C)(C)C)=O)c1ccc(C)c(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.603 |
| logD: | 3.603 |
| logSw: | -3.6447 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.72 |
| InChI Key: | CWDCUBGMOBEHCC-ZDUSSCGKSA-N |