3-hydroxy-4-(2-hydroxy-5-nitrophenyl)-2-phenyl-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Chemical Structure Depiction of
3-hydroxy-4-(2-hydroxy-5-nitrophenyl)-2-phenyl-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
3-hydroxy-4-(2-hydroxy-5-nitrophenyl)-2-phenyl-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Compound characteristics
| Compound ID: | 6882-0497 |
| Compound Name: | 3-hydroxy-4-(2-hydroxy-5-nitrophenyl)-2-phenyl-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 418.41 |
| Molecular Formula: | C22 H18 N4 O5 |
| Smiles: | C1CC2=C(C(c3cc(ccc3O)[N+]([O-])=O)c3c(N2)nn(c2ccccc2)c3O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3048 |
| logD: | 2.5608 |
| logSw: | -3.4414 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.048 |
| InChI Key: | NYLOEDBKKRSNNV-SFHVURJKSA-N |