N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methoxyacetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methoxyacetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methoxyacetamide
Compound characteristics
| Compound ID: | V008-1461 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methoxyacetamide |
| Molecular Weight: | 538 |
| Molecular Formula: | C27 H28 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | COCC(N(CC(N1CCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3792 |
| logD: | 2.3754 |
| logSw: | -3.3912 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.049 |
| InChI Key: | SFHHXDDJMNNHJS-UHFFFAOYSA-N |