2-(5-chloro-2-nitrophenyl)-4-(4-fluorophenyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
2-(5-chloro-2-nitrophenyl)-4-(4-fluorophenyl)phthalazin-1(2H)-one
2-(5-chloro-2-nitrophenyl)-4-(4-fluorophenyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 2023-0307 |
| Compound Name: | 2-(5-chloro-2-nitrophenyl)-4-(4-fluorophenyl)phthalazin-1(2H)-one |
| Molecular Weight: | 395.78 |
| Molecular Formula: | C20 H11 Cl F N3 O3 |
| Smiles: | c1ccc2C(N(c3cc(ccc3[N+]([O-])=O)[Cl])N=C(c3ccc(cc3)F)c2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.631 |
| logD: | 4.631 |
| logSw: | -5.0304 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.556 |
| InChI Key: | KDSIYTJEBYGDIP-UHFFFAOYSA-N |