N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-phenylacetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-phenylacetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-phenylacetamide
Compound characteristics
| Compound ID: | V001-0984 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-phenylacetamide |
| Molecular Weight: | 579.66 |
| Molecular Formula: | C33 H33 N5 O5 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1ccc(nn1)N1CCN(CC1)C(CN(Cc1ccc2c(c1)OCO2)C(Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1768 |
| logD: | 4.065 |
| logSw: | -4.3947 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.897 |
| InChI Key: | WMFPLOQFUPRIOD-UHFFFAOYSA-N |