6-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
Chemical Structure Depiction of
6-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
6-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
Compound characteristics
| Compound ID: | E854-5127 |
| Compound Name: | 6-[1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]-3,4-dimethyl-2-(4-methylphenyl)-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C25 H31 N5 O4 |
| Smiles: | CCC(C(N1CCC2(CC1)OCCO2)=O)N1C(c2c(C(C)=N1)c(C)n(c1ccc(C)cc1)n2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.755 |
| logD: | 2.755 |
| logSw: | -2.7974 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.817 |
| InChI Key: | GOPAYEXOMMCXRU-FQEVSTJZSA-N |