(piperidin-1-yl){4-[(4-{4-[(prop-2-yn-1-yl)oxy]phenyl}phthalazin-1-yl)amino]phenyl}methanone
Chemical Structure Depiction of
(piperidin-1-yl){4-[(4-{4-[(prop-2-yn-1-yl)oxy]phenyl}phthalazin-1-yl)amino]phenyl}methanone
(piperidin-1-yl){4-[(4-{4-[(prop-2-yn-1-yl)oxy]phenyl}phthalazin-1-yl)amino]phenyl}methanone
Compound characteristics
| Compound ID: | 5754-2820 |
| Compound Name: | (piperidin-1-yl){4-[(4-{4-[(prop-2-yn-1-yl)oxy]phenyl}phthalazin-1-yl)amino]phenyl}methanone |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C29 H26 N4 O2 |
| Smiles: | C#CCOc1ccc(cc1)c1c2ccccc2c(Nc2ccc(cc2)C(N2CCCCC2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.7607 |
| logD: | 4.7604 |
| logSw: | -4.8102 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.827 |
| InChI Key: | ZPBFNAVJDOSCCE-UHFFFAOYSA-N |