N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide
Compound characteristics
| Compound ID: | V024-2127 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide |
| Molecular Weight: | 536.42 |
| Molecular Formula: | C27 H23 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1c2ccccc2c(nn1)N1CCN(CC1)c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5646 |
| logD: | 5.5646 |
| logSw: | -6.1125 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.655 |
| InChI Key: | YMHSJZLXDDVUKN-UHFFFAOYSA-N |