N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)furan-2-carboxamide
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)furan-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | V008-1495 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)furan-2-carboxamide |
| Molecular Weight: | 560.01 |
| Molecular Formula: | C29 H26 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(CN(Cc1ccc2c(c1)OCO2)C(c1ccco1)=O)=O)c1ccc(c2ccccc2[Cl])nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.5994 |
| logD: | 3.5957 |
| logSw: | -3.8911 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.459 |
| InChI Key: | GYGMTTIJBMYEMY-UHFFFAOYSA-N |