6-[4-(azepan-1-yl)-4-oxobutyl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
Chemical Structure Depiction of
6-[4-(azepan-1-yl)-4-oxobutyl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
6-[4-(azepan-1-yl)-4-oxobutyl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
Compound characteristics
| Compound ID: | E854-6554 |
| Compound Name: | 6-[4-(azepan-1-yl)-4-oxobutyl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C24 H31 N5 O2 |
| Smiles: | CC1c2c(C(N(CCCC(N3CCCCCC3)=O)N=1)=O)nn(c1ccc(C)cc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 3.0638 |
| logD: | 3.0635 |
| logSw: | -3.1772 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.044 |
| InChI Key: | RWVIKOQDLWWPGC-UHFFFAOYSA-N |