4-(2,2-dimethylpropanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one
Chemical Structure Depiction of
4-(2,2-dimethylpropanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one
4-(2,2-dimethylpropanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one
Compound characteristics
| Compound ID: | V024-3041 |
| Compound Name: | 4-(2,2-dimethylpropanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one |
| Molecular Weight: | 319.36 |
| Molecular Formula: | C16 H21 N3 O4 |
| Smiles: | CC1C(N(CCN1C(C(C)(C)C)=O)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4226 |
| logD: | 2.4226 |
| logSw: | -2.5071 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.629 |
| InChI Key: | XALDSNGERMYQPP-NSHDSACASA-N |