7,9-dimethyl-11-(3-methylphenyl)-6-(3-nitrophenyl)-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione
Chemical Structure Depiction of
7,9-dimethyl-11-(3-methylphenyl)-6-(3-nitrophenyl)-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione
7,9-dimethyl-11-(3-methylphenyl)-6-(3-nitrophenyl)-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione
Compound characteristics
| Compound ID: | D359-0137 |
| Compound Name: | 7,9-dimethyl-11-(3-methylphenyl)-6-(3-nitrophenyl)-6,7-dihydropyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(5H,9H)-dione |
| Molecular Weight: | 493.52 |
| Molecular Formula: | C28 H23 N5 O4 |
| Smiles: | Cc1cccc(c1)c1c2C(N(C)C(N(C)c2c2C(c3cccc(c3)[N+]([O-])=O)Nc3ccccc3n12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.462 |
| logD: | 5.462 |
| logSw: | -5.5742 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.409 |
| InChI Key: | RQDNABWFHHMLQB-HSZRJFAPSA-N |