N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-3-methoxybenzamide
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)-3-methoxybenzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | V023-5816 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-3-methoxybenzamide |
| Molecular Weight: | 600.07 |
| Molecular Formula: | C32 H30 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(N(CC(N1CCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1606 |
| logD: | 4.1569 |
| logSw: | -4.4909 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.425 |
| InChI Key: | RFIHCSLJPPIWEW-UHFFFAOYSA-N |