methyl 2-[1-(4-ethoxyphenyl)-7-fluoro-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
methyl 2-[1-(4-ethoxyphenyl)-7-fluoro-3,9-dioxo-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
methyl 2-[1-(4-ethoxyphenyl)-7-fluoro-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: | 6872-4381 |
| Compound Name: | methyl 2-[1-(4-ethoxyphenyl)-7-fluoro-3,9-dioxo-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 494.5 |
| Molecular Formula: | C25 H19 F N2 O6 S |
| Smiles: | CCOc1ccc(cc1)C1C2=C(C(N1c1nc(C)c(C(=O)OC)s1)=O)Oc1ccc(cc1C2=O)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7265 |
| logD: | 4.7264 |
| logSw: | -4.724 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.816 |
| InChI Key: | XUSDYXHGBKADLE-LJQANCHMSA-N |