2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
Chemical Structure Depiction of
2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
Compound characteristics
Compound ID: | F046-0522 |
Compound Name: | 2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide |
Molecular Weight: | 479.55 |
Molecular Formula: | C26 H30 F N5 O3 |
Smiles: | CC(C)Oc1ccc(CNC(CN2C(C=CC(=N2)N2CCN(CC2)c2ccc(cc2)F)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.1734 |
logD: | 3.1734 |
logSw: | -3.3075 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.658 |
InChI Key: | CMQLOEASXNEZJP-UHFFFAOYSA-N |