ethyl 2-[3,9-dioxo-1-(pyridin-3-yl)-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-[3,9-dioxo-1-(pyridin-3-yl)-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-[3,9-dioxo-1-(pyridin-3-yl)-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 6391-0259 |
| Compound Name: | ethyl 2-[3,9-dioxo-1-(pyridin-3-yl)-3,9-dihydro[1]benzopyrano[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 447.47 |
| Molecular Formula: | C23 H17 N3 O5 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C3=C(C2=O)Oc2ccccc2C3=O)c2cccnc2)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3863 |
| logD: | 3.367 |
| logSw: | -3.6578 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.79 |
| InChI Key: | DKMRAOISBGKHAY-QGZVFWFLSA-N |