4-(difluoromethyl)-2-ethyl-7-(3-{4-[(furan-2-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3-methyl-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(difluoromethyl)-2-ethyl-7-(3-{4-[(furan-2-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3-methyl-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(difluoromethyl)-2-ethyl-7-(3-{4-[(furan-2-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3-methyl-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | Y505-3025 |
| Compound Name: | 4-(difluoromethyl)-2-ethyl-7-(3-{4-[(furan-2-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3-methyl-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 447.48 |
| Molecular Formula: | C22 H27 F2 N5 O3 |
| Smiles: | CCn1c(C)c2C(=CC(N(CCC(N3CCN(CC3)Cc3ccco3)=O)c2n1)=O)C(F)F |
| Stereo: | ACHIRAL |
| logP: | 1.0169 |
| logD: | 1.0064 |
| logSw: | -1.8341 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.263 |
| InChI Key: | GHUXPVRAQFKDNZ-UHFFFAOYSA-N |