N-(4-bromo-2-methylphenyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
N-(4-bromo-2-methylphenyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C434-0029 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide |
| Molecular Weight: | 412.24 |
| Molecular Formula: | C19 H14 Br N3 O3 |
| Smiles: | Cc1cc(ccc1NC(Cn1c2c3ccccc3OC(c2cn1)=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.6257 |
| logD: | 3.6256 |
| logSw: | -3.7567 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.91 |
| InChI Key: | GDFMSOSGVDGYBL-UHFFFAOYSA-N |