3-cyclohexyl-6-hydroxy-5-[5-(3-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-cyclohexyl-6-hydroxy-5-[5-(3-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
3-cyclohexyl-6-hydroxy-5-[5-(3-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-1395 |
| Compound Name: | 3-cyclohexyl-6-hydroxy-5-[5-(3-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C22 H25 N5 O6 |
| Smiles: | CCC(N1C(CC(C2=C(NC(N(C3CCCCC3)C2=O)=O)O)=N1)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9612 |
| logD: | -2.1042 |
| logSw: | -3.1775 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.874 |
| InChI Key: | CCCYZMFUYASYTF-KRWDZBQOSA-N |