N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)propanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)propanamide
N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)propanamide
Compound characteristics
| Compound ID: | E854-2417 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)propanamide |
| Molecular Weight: | 449.94 |
| Molecular Formula: | C24 H24 Cl N5 O2 |
| Smiles: | CC1c2c(C(N(CCC(NCCc3ccc(cc3)[Cl])=O)N=1)=O)nn(c1ccccc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 2.9277 |
| logD: | 2.9266 |
| logSw: | -3.8406 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.634 |
| InChI Key: | FDXCMSPTKWOTMZ-UHFFFAOYSA-N |