2-(6-bromo-3-oxo-2-phenyl-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl)-N-(2-methylphenyl)acetamide
Chemical Structure Depiction of
2-(6-bromo-3-oxo-2-phenyl-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl)-N-(2-methylphenyl)acetamide
2-(6-bromo-3-oxo-2-phenyl-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl)-N-(2-methylphenyl)acetamide
Compound characteristics
Compound ID: | G300-0485 |
Compound Name: | 2-(6-bromo-3-oxo-2-phenyl-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl)-N-(2-methylphenyl)acetamide |
Molecular Weight: | 490.36 |
Molecular Formula: | C25 H20 Br N3 O3 |
Smiles: | Cc1ccccc1NC(CN1C2=C(Cc3cc(ccc3O2)[Br])C(N1c1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6797 |
logD: | 4.6797 |
logSw: | -4.508 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.778 |
InChI Key: | IBCLVQUGZVIOOF-UHFFFAOYSA-N |