5-(2-hydroxy-5-nitrophenyl)-1,3-dimethyl-5,5a-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
Chemical Structure Depiction of
5-(2-hydroxy-5-nitrophenyl)-1,3-dimethyl-5,5a-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
5-(2-hydroxy-5-nitrophenyl)-1,3-dimethyl-5,5a-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
Compound characteristics
| Compound ID: | 3807-4034 |
| Compound Name: | 5-(2-hydroxy-5-nitrophenyl)-1,3-dimethyl-5,5a-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione |
| Molecular Weight: | 432.39 |
| Molecular Formula: | C22 H16 N4 O6 |
| Smiles: | CN1C2=C(C(C3C(c4ccccc4C3=O)=N2)c2cc(ccc2O)[N+]([O-])=O)C(N(C)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7466 |
| logD: | 0.8874 |
| logSw: | -3.2808 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.67 |
| InChI Key: | STBQPUKVEJMZMN-UHFFFAOYSA-N |