2-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-7,8-dimethoxyphthalazin-1(2H)-one
Chemical Structure Depiction of
2-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-7,8-dimethoxyphthalazin-1(2H)-one
2-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-7,8-dimethoxyphthalazin-1(2H)-one
Compound characteristics
| Compound ID: | Y043-2801 |
| Compound Name: | 2-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-7,8-dimethoxyphthalazin-1(2H)-one |
| Molecular Weight: | 428.92 |
| Molecular Formula: | C22 H25 Cl N4 O3 |
| Smiles: | COc1ccc2C=NN(CN3CCN(CC3)Cc3cccc(c3)[Cl])C(c2c1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6972 |
| logD: | 2.4046 |
| logSw: | -3.7254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.544 |
| InChI Key: | VDHKIUUXTIDAOW-UHFFFAOYSA-N |