methyl 4-{7-fluoro-2-[2-(4-methoxyphenyl)ethyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{7-fluoro-2-[2-(4-methoxyphenyl)ethyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate
methyl 4-{7-fluoro-2-[2-(4-methoxyphenyl)ethyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | Y070-3955 |
| Compound Name: | methyl 4-{7-fluoro-2-[2-(4-methoxyphenyl)ethyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate |
| Molecular Weight: | 487.48 |
| Molecular Formula: | C28 H22 F N O6 |
| Smiles: | COC(c1ccc(cc1)C1C2=C(C(N1CCc1ccc(cc1)OC)=O)Oc1ccc(cc1C2=O)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0407 |
| logD: | 5.0407 |
| logSw: | -4.7259 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.429 |
| InChI Key: | NEKZOUXQYSRQAR-XMMPIXPASA-N |