N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}propanamide
Compound characteristics
| Compound ID: | V028-1253 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}propanamide |
| Molecular Weight: | 501.59 |
| Molecular Formula: | C28 H31 N5 O4 |
| Salt: | not_available |
| Smiles: | CC(C)C(N(CC(N1CCN(CC1)c1ccc(c2ccccc2)nn1)=O)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4543 |
| logD: | 3.4505 |
| logSw: | -3.6164 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.153 |
| InChI Key: | YZCWNVYFLCSTPS-UHFFFAOYSA-N |