2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | Y070-4794 |
| Compound Name: | 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-nitrophenyl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 486.48 |
| Molecular Formula: | C27 H22 N2 O7 |
| Smiles: | COc1ccc(CCN2C(C3=C(C2=O)Oc2ccccc2C3=O)c2ccc(cc2)[N+]([O-])=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1832 |
| logD: | 4.1832 |
| logSw: | -4.4477 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.354 |
| InChI Key: | CIOOEDYFRDCZNM-XMMPIXPASA-N |