N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]-4-nitrobenzamide
N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 6434-3748 |
| Compound Name: | N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]-4-nitrobenzamide |
| Molecular Weight: | 483.53 |
| Molecular Formula: | C27 H25 N5 O4 |
| Smiles: | COc1c2ccccc2c(c2ccc(c(c2)NC(c2ccc(cc2)[N+]([O-])=O)=O)N2CCCCC2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 5.6777 |
| logD: | 5.6333 |
| logSw: | -5.6822 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.437 |
| InChI Key: | IDWOWELTCAFQIT-UHFFFAOYSA-N |