methyl 6-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]-2H-1,3-benzodioxole-5-carboxylate
Chemical Structure Depiction of
methyl 6-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]-2H-1,3-benzodioxole-5-carboxylate
methyl 6-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]-2H-1,3-benzodioxole-5-carboxylate
Compound characteristics
| Compound ID: | C618-0882 |
| Compound Name: | methyl 6-[2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamido]-2H-1,3-benzodioxole-5-carboxylate |
| Molecular Weight: | 435.39 |
| Molecular Formula: | C22 H17 N3 O7 |
| Smiles: | Cc1ccc2c(c1)c1c(cnn1CC(Nc1cc3c(cc1C(=O)OC)OCO3)=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.945 |
| logD: | 2.7377 |
| logSw: | -3.1787 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.199 |
| InChI Key: | YECLANSWMNGQIS-UHFFFAOYSA-N |