4-(azepan-1-yl)-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(azepan-1-yl)-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phthalazin-1(2H)-one
4-(azepan-1-yl)-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | M183-0794 |
| Compound Name: | 4-(azepan-1-yl)-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phthalazin-1(2H)-one |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C26 H30 F N5 O2 |
| Smiles: | C1CCCN(CC1)C1c2ccccc2C(N(CC(N2CCN(CC2)c2ccc(cc2)F)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3443 |
| logD: | 3.3442 |
| logSw: | -3.6519 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.221 |
| InChI Key: | XDQVZTMUFJQGPD-UHFFFAOYSA-N |