4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[2-(2-methoxyphenyl)ethyl]butanamide
Chemical Structure Depiction of
4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[2-(2-methoxyphenyl)ethyl]butanamide
4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[2-(2-methoxyphenyl)ethyl]butanamide
Compound characteristics
| Compound ID: | E854-6593 |
| Compound Name: | 4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[2-(2-methoxyphenyl)ethyl]butanamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C27 H31 N5 O3 |
| Smiles: | CC1c2c(C(N(CCCC(NCCc3ccccc3OC)=O)N=1)=O)nn(c1ccc(C)cc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 2.9229 |
| logD: | 2.9226 |
| logSw: | -3.3555 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.264 |
| InChI Key: | KQUCHUHSVBZADY-UHFFFAOYSA-N |