6-(2-hydroxy-5-nitrophenyl)-7,9-dimethyl-11-phenyl-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione
Chemical Structure Depiction of
6-(2-hydroxy-5-nitrophenyl)-7,9-dimethyl-11-phenyl-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione
6-(2-hydroxy-5-nitrophenyl)-7,9-dimethyl-11-phenyl-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione
Compound characteristics
| Compound ID: | D359-0039 |
| Compound Name: | 6-(2-hydroxy-5-nitrophenyl)-7,9-dimethyl-11-phenyl-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione |
| Molecular Weight: | 495.49 |
| Molecular Formula: | C27 H21 N5 O5 |
| Smiles: | CN1C(c2c(c3C(c4cc(ccc4O)[N+]([O-])=O)Nc4ccccc4n3c2c2ccccc2)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7946 |
| logD: | 4.6375 |
| logSw: | -4.5048 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.957 |
| InChI Key: | JCLFREWUOHYODM-JOCHJYFZSA-N |