4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[2-(4-methylphenyl)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-(4-methylphenyl)ethyl]butanamide
4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[2-(4-methylphenyl)ethyl]butanamide
Compound characteristics
| Compound ID: | E854-6447 |
| Compound Name: | 4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[2-(4-methylphenyl)ethyl]butanamide |
| Molecular Weight: | 457.58 |
| Molecular Formula: | C27 H31 N5 O2 |
| Smiles: | CC1c2c(C(N(CCCC(NCCc3ccc(C)cc3)=O)N=1)=O)nn(c1ccc(C)cc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 3.0605 |
| logD: | 3.0602 |
| logSw: | -3.3174 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.634 |
| InChI Key: | RMKFORZNKDJJAG-UHFFFAOYSA-N |