N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dichloro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dichloro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dichloro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V003-5735 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dichloro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 618.52 |
| Molecular Formula: | C32 H29 Cl2 N5 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1ccc(nn1)N1CCN(CC1)C(CN(Cc1ccc2c(c1)OCO2)C(c1ccc(cc1[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4853 |
| logD: | 5.4646 |
| logSw: | -5.9212 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.881 |
| InChI Key: | BUVMUJWVBOREBC-UHFFFAOYSA-N |