N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]propanamide
Compound characteristics
| Compound ID: | K786-8721 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]propanamide |
| Molecular Weight: | 391.43 |
| Molecular Formula: | C22 H21 N3 O4 |
| Smiles: | Cc1ccc(cc1)C1C=CC(N(CCC(NCc2ccc3c(c2)OCO3)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0207 |
| logD: | 3.0207 |
| logSw: | -3.2499 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.113 |
| InChI Key: | IXORWZNUHRGUIM-UHFFFAOYSA-N |