6,7-dimethyl-1-[4-(methylsulfanyl)phenyl]-2-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
6,7-dimethyl-1-[4-(methylsulfanyl)phenyl]-2-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
6,7-dimethyl-1-[4-(methylsulfanyl)phenyl]-2-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | Y070-4189 |
| Compound Name: | 6,7-dimethyl-1-[4-(methylsulfanyl)phenyl]-2-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 451.58 |
| Molecular Formula: | C26 H29 N O4 S |
| Smiles: | CC(C)OCCCN1C(C2=C(C1=O)Oc1cc(C)c(C)cc1C2=O)c1ccc(cc1)SC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3877 |
| logD: | 5.3877 |
| logSw: | -5.3694 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.184 |
| InChI Key: | XOCLJPACXLKMCQ-HSZRJFAPSA-N |