1-(5-chloro-2-methylphenyl)-4-(3,3-dimethylbutanoyl)-3-methylpiperazin-2-one
Chemical Structure Depiction of
1-(5-chloro-2-methylphenyl)-4-(3,3-dimethylbutanoyl)-3-methylpiperazin-2-one
1-(5-chloro-2-methylphenyl)-4-(3,3-dimethylbutanoyl)-3-methylpiperazin-2-one
Compound characteristics
| Compound ID: | V018-8027 |
| Compound Name: | 1-(5-chloro-2-methylphenyl)-4-(3,3-dimethylbutanoyl)-3-methylpiperazin-2-one |
| Molecular Weight: | 336.86 |
| Molecular Formula: | C18 H25 Cl N2 O2 |
| Smiles: | CC1C(N(CCN1C(CC(C)(C)C)=O)c1cc(ccc1C)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9925 |
| logD: | 3.9925 |
| logSw: | -4.3612 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.4192 |
| InChI Key: | XKQWGFDQEHYYJP-UHFFFAOYSA-N |