methyl 2-[1-(4-ethylphenyl)-7-methyl-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-ethylphenyl)-7-methyl-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-ethylphenyl)-7-methyl-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: | 6872-3415 |
| Compound Name: | methyl 2-[1-(4-ethylphenyl)-7-methyl-3,9-dioxo-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C26 H22 N2 O5 S |
| Smiles: | CCc1ccc(cc1)C1C2=C(C(N1c1nc(C)c(C(=O)OC)s1)=O)Oc1ccc(C)cc1C2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4692 |
| logD: | 5.4692 |
| logSw: | -5.491 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.693 |
| InChI Key: | DWNQGUGCMIDRJK-HXUWFJFHSA-N |