ethyl 2-{3,9-dioxo-1-[4-(propan-2-yl)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-[4-(propan-2-yl)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-[4-(propan-2-yl)phenyl]-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 6391-0271 |
| Compound Name: | ethyl 2-{3,9-dioxo-1-[4-(propan-2-yl)phenyl]-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C27 H24 N2 O5 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C3=C(C2=O)Oc2ccccc2C3=O)c2ccc(cc2)C(C)C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8883 |
| logD: | 5.8882 |
| logSw: | -5.6175 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.272 |
| InChI Key: | ITEHDEGPUSTUCE-OAQYLSRUSA-N |