1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}-2-(4-nitrophenoxy)ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}-2-(4-nitrophenoxy)ethan-1-one
1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}-2-(4-nitrophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | 6434-3693 |
| Compound Name: | 1-{4-[4-(4-methylphenyl)phthalazin-1-yl]piperazin-1-yl}-2-(4-nitrophenoxy)ethan-1-one |
| Molecular Weight: | 483.53 |
| Molecular Formula: | C27 H25 N5 O4 |
| Smiles: | Cc1ccc(cc1)c1c2ccccc2c(nn1)N1CCN(CC1)C(COc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.408 |
| logD: | 4.4077 |
| logSw: | -4.2841 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.404 |
| InChI Key: | VSQYBMCHXHTBMP-UHFFFAOYSA-N |