2-[2-(4-methoxyphenyl)ethyl]-1-[4-(methylsulfanyl)phenyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Chemical Structure Depiction of
2-[2-(4-methoxyphenyl)ethyl]-1-[4-(methylsulfanyl)phenyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
2-[2-(4-methoxyphenyl)ethyl]-1-[4-(methylsulfanyl)phenyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione
Compound characteristics
| Compound ID: | Y070-3454 |
| Compound Name: | 2-[2-(4-methoxyphenyl)ethyl]-1-[4-(methylsulfanyl)phenyl]-1,2-dihydro[1]benzopyrano[2,3-c]pyrrole-3,9-dione |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C27 H23 N O4 S |
| Smiles: | COc1ccc(CCN2C(C3=C(C2=O)Oc2ccccc2C3=O)c2ccc(cc2)SC)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4422 |
| logD: | 5.4422 |
| logSw: | -5.5066 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.255 |
| InChI Key: | QOMMBGJBLSMCJL-XMMPIXPASA-N |