N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | V026-0691 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethyl}benzamide |
| Molecular Weight: | 549.63 |
| Molecular Formula: | C32 H31 N5 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N(CC(N1CCN(CC1)c1ccc(c2ccccc2)nn1)=O)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2459 |
| logD: | 4.2422 |
| logSw: | -4.2459 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.881 |
| InChI Key: | QAOAKNQHEILBGZ-UHFFFAOYSA-N |