N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-chlorophenyl)-6-oxopyridazin-1(6H)-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-chlorophenyl)-6-oxopyridazin-1(6H)-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-chlorophenyl)-6-oxopyridazin-1(6H)-yl]propanamide
Compound characteristics
| Compound ID: | K786-8455 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[3-(4-chlorophenyl)-6-oxopyridazin-1(6H)-yl]propanamide |
| Molecular Weight: | 411.84 |
| Molecular Formula: | C21 H18 Cl N3 O4 |
| Smiles: | C(CN1C(C=CC(c2ccc(cc2)[Cl])=N1)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.192 |
| logD: | 3.192 |
| logSw: | -3.7139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.113 |
| InChI Key: | YVZXWGBWGXDEHM-UHFFFAOYSA-N |