N-(4-bromo-2-methylphenyl)-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
N-(4-bromo-2-methylphenyl)-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C762-0029 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide |
| Molecular Weight: | 412.28 |
| Molecular Formula: | C20 H18 Br N3 O2 |
| Smiles: | Cc1ccc2c(c1)c1c(CO2)cnn1CC(Nc1ccc(cc1C)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.987 |
| logD: | 3.9868 |
| logSw: | -4.0318 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.358 |
| InChI Key: | NIQYUSKIFHETKP-UHFFFAOYSA-N |