dimethyl 5-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]benzene-1,3-dicarboxylate
dimethyl 5-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C618-0824 |
| Compound Name: | dimethyl 5-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 449.42 |
| Molecular Formula: | C23 H19 N3 O7 |
| Smiles: | Cc1ccc2c(c1)c1c(cnn1CC(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.7213 |
| logD: | 3.7213 |
| logSw: | -3.9646 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.955 |
| InChI Key: | WCKBUAAWXPTNJX-UHFFFAOYSA-N |