4-(4-fluorophenyl)-2-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(4-fluorophenyl)-2-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]phthalazin-1(2H)-one
4-(4-fluorophenyl)-2-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 8006-7752 |
| Compound Name: | 4-(4-fluorophenyl)-2-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]phthalazin-1(2H)-one |
| Molecular Weight: | 459.48 |
| Molecular Formula: | C25 H22 F N5 O3 |
| Smiles: | CN1CCN(CC1)c1ccc(c(c1)N1C(c2ccccc2C(c2ccc(cc2)F)=N1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7291 |
| logD: | 3.161 |
| logSw: | -4.0403 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.485 |
| InChI Key: | LEWHGNBHEWOUBE-UHFFFAOYSA-N |