1-[4-(4-nitrophenyl)piperazin-1-yl]-4-[(pyridin-3-yl)methyl]phthalazine
Chemical Structure Depiction of
1-[4-(4-nitrophenyl)piperazin-1-yl]-4-[(pyridin-3-yl)methyl]phthalazine
1-[4-(4-nitrophenyl)piperazin-1-yl]-4-[(pyridin-3-yl)methyl]phthalazine
Compound characteristics
Compound ID: | C696-0046 |
Compound Name: | 1-[4-(4-nitrophenyl)piperazin-1-yl]-4-[(pyridin-3-yl)methyl]phthalazine |
Molecular Weight: | 426.48 |
Molecular Formula: | C24 H22 N6 O2 |
Smiles: | C(c1cccnc1)c1c2ccccc2c(nn1)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.9037 |
logD: | 3.8563 |
logSw: | -4.0278 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 72.249 |
InChI Key: | YAIPHROMDNSGLA-UHFFFAOYSA-N |