ethyl 2-{1-[4-(methoxycarbonyl)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-[4-(methoxycarbonyl)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-[4-(methoxycarbonyl)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: | 6391-0275 |
| Compound Name: | ethyl 2-{1-[4-(methoxycarbonyl)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: | 504.52 |
| Molecular Formula: | C26 H20 N2 O7 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C3=C(C2=O)Oc2ccccc2C3=O)c2ccc(cc2)C(=O)OC)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6408 |
| logD: | 4.6408 |
| logSw: | -4.61 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.446 |
| InChI Key: | LQXVZUFRLKKWMX-LJQANCHMSA-N |