2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
Chemical Structure Depiction of
2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
Compound characteristics
| Compound ID: | E860-2802 |
| Compound Name: | 2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C22 H25 N5 O3 S |
| Smiles: | Cc1c2c(c(nn1)SCC(N1CCC3(CC1)OCCO3)=O)nn(c1ccccc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 1.7116 |
| logD: | 1.7115 |
| logSw: | -2.1675 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.574 |
| InChI Key: | PCDDQZMLIUJEEM-UHFFFAOYSA-N |