4-(4-amino-3-nitrophenyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(4-amino-3-nitrophenyl)phthalazin-1(2H)-one
4-(4-amino-3-nitrophenyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 0479-0685 |
| Compound Name: | 4-(4-amino-3-nitrophenyl)phthalazin-1(2H)-one |
| Molecular Weight: | 282.26 |
| Molecular Formula: | C14 H10 N4 O3 |
| Smiles: | c1ccc2C(NN=C(c3ccc(c(c3)[N+]([O-])=O)N)c2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.04 |
| logD: | 2.0398 |
| logSw: | -3.0018 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.535 |
| InChI Key: | AOALQZIZSREBQY-UHFFFAOYSA-N |