prop-2-en-1-yl 2-[3,9-dioxo-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 2-[3,9-dioxo-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
prop-2-en-1-yl 2-[3,9-dioxo-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 6391-0323 |
| Compound Name: | prop-2-en-1-yl 2-[3,9-dioxo-1-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 514.56 |
| Molecular Formula: | C28 H22 N2 O6 S |
| Smiles: | Cc1c(C(=O)OCC=C)sc(n1)N1C(C2=C(C1=O)Oc1ccccc1C2=O)c1ccc(cc1)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0876 |
| logD: | 5.0876 |
| logSw: | -5.091 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.984 |
| InChI Key: | HCVZOKNTUDPJJI-JOCHJYFZSA-N |