6,7-dimethyl-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(pyridin-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
6,7-dimethyl-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(pyridin-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
6,7-dimethyl-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(pyridin-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | 6872-5113 |
| Compound Name: | 6,7-dimethyl-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(pyridin-2-yl)-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C27 H22 N2 O4 |
| Smiles: | Cc1cc2C(C3C(c4ccc(cc4)OCC=C)N(C(C=3Oc2cc1C)=O)c1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3764 |
| logD: | 5.3764 |
| logSw: | -5.5097 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.05 |
| InChI Key: | KXLSWFREAWKRQB-XMMPIXPASA-N |