ethyl 2-[3,9-dioxo-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-[3,9-dioxo-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-[3,9-dioxo-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 6391-0281 |
| Compound Name: | ethyl 2-[3,9-dioxo-1-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 502.55 |
| Molecular Formula: | C27 H22 N2 O6 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C3=C(C2=O)Oc2ccccc2C3=O)c2cccc(c2)OCC=C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1219 |
| logD: | 5.1219 |
| logSw: | -5.1055 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.69 |
| InChI Key: | RPIKWXJPFLGWSE-OAQYLSRUSA-N |