(2E)-N-{1-[4-(cyclohexanecarbonyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-3-(4-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
(2E)-N-{1-[4-(cyclohexanecarbonyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-3-(4-nitrophenyl)prop-2-enamide
(2E)-N-{1-[4-(cyclohexanecarbonyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-3-(4-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | V009-5557 |
| Compound Name: | (2E)-N-{1-[4-(cyclohexanecarbonyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-3-(4-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 498.62 |
| Molecular Formula: | C27 H38 N4 O5 |
| Smiles: | CCC(C)C(C(N1CCN(C(C)C1)C(C1CCCCC1)=O)=O)NC(/C=C/c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1894 |
| logD: | 4.1894 |
| logSw: | -4.0673 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.959 |
| InChI Key: | DRMPAOAPAZKIDC-NTCAYCPXSA-N |