2-[4-(3-nitrophenyl)-1-oxophthalazin-2(1H)-yl]-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-[4-(3-nitrophenyl)-1-oxophthalazin-2(1H)-yl]-N-(propan-2-yl)acetamide
2-[4-(3-nitrophenyl)-1-oxophthalazin-2(1H)-yl]-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | 6434-3802 |
| Compound Name: | 2-[4-(3-nitrophenyl)-1-oxophthalazin-2(1H)-yl]-N-(propan-2-yl)acetamide |
| Molecular Weight: | 366.37 |
| Molecular Formula: | C19 H18 N4 O4 |
| Smiles: | CC(C)NC(CN1C(c2ccccc2C(c2cccc(c2)[N+]([O-])=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3097 |
| logD: | 2.3097 |
| logSw: | -3.1691 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.294 |
| InChI Key: | SCWSPTMMAJYBCQ-UHFFFAOYSA-N |