N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V007-8680 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 600.07 |
| Molecular Formula: | C32 H30 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1ccc(nn1)N1CCN(CC1)C(CN(Cc1ccc2c(c1)OCO2)C(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2801 |
| logD: | 4.1682 |
| logSw: | -4.5376 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.425 |
| InChI Key: | CEVCOSOVUXXYJA-UHFFFAOYSA-N |