4-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidine-1-carbonyl}phthalazin-1(2H)-one
Chemical Structure Depiction of
4-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidine-1-carbonyl}phthalazin-1(2H)-one
4-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidine-1-carbonyl}phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | S723-0813 |
| Compound Name: | 4-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidine-1-carbonyl}phthalazin-1(2H)-one |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C27 H26 N4 O3 |
| Smiles: | C1CN(CCC1Cc1ccc(COc2ccncc2)cc1)C(C1c2ccccc2C(NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2785 |
| logD: | 2.8902 |
| logSw: | -3.5392 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.662 |
| InChI Key: | DKUJAVYUAJBZKC-UHFFFAOYSA-N |