ethyl 2-[1-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dioxo-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-[1-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dioxo-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-[1-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dioxo-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 6391-0289 |
| Compound Name: | ethyl 2-[1-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dioxo-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 546.6 |
| Molecular Formula: | C29 H26 N2 O7 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C3=C(C2=O)Oc2ccccc2C3=O)c2ccc(c(c2)OCC)OCC=C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1424 |
| logD: | 5.1424 |
| logSw: | -5.1119 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.987 |
| InChI Key: | HKRSXVGXZWDKHS-HSZRJFAPSA-N |