N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]butanamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]butanamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]butanamide
Compound characteristics
| Compound ID: | E854-6475 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]butanamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C26 H33 N5 O2 |
| Smiles: | CC1c2c(C(N(CCCC(NCCC3CCCCC=3)=O)N=1)=O)nn(c1ccc(C)cc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 3.0076 |
| logD: | 3.0073 |
| logSw: | -3.2676 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.826 |
| InChI Key: | KVMWRHXPIIXUTQ-UHFFFAOYSA-N |