N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C618-0759 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-methyl-4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide |
| Molecular Weight: | 391.38 |
| Molecular Formula: | C21 H17 N3 O5 |
| Smiles: | Cc1ccc2c(c1)c1c(cnn1CC(NCc1ccc3c(c1)OCO3)=O)C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.7233 |
| logD: | 2.7233 |
| logSw: | -3.1513 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.045 |
| InChI Key: | QSFRNOZCFUWWQP-UHFFFAOYSA-N |