N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methoxy-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methoxy-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methoxy-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)acetamide
Compound characteristics
| Compound ID: | V003-4380 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methoxy-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)acetamide |
| Molecular Weight: | 517.58 |
| Molecular Formula: | C28 H31 N5 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1ccc(nn1)N1CCN(CC1)C(CN(Cc1ccc2c(c1)OCO2)C(COC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5477 |
| logD: | 2.527 |
| logSw: | -2.7761 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.049 |
| InChI Key: | ZSTXQQUMXIVKRR-UHFFFAOYSA-N |