6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3,4-dimethyl-2-phenyl-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
Chemical Structure Depiction of
6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3,4-dimethyl-2-phenyl-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3,4-dimethyl-2-phenyl-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one
Compound characteristics
Compound ID: | E854-0271 |
Compound Name: | 6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3,4-dimethyl-2-phenyl-2,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one |
Molecular Weight: | 455.56 |
Molecular Formula: | C27 H29 N5 O2 |
Smiles: | CC1c2c(C(N(CC(N3CCC(CC3)Cc3ccccc3)=O)N=1)=O)nn(c1ccccc1)c2C |
Stereo: | ACHIRAL |
logP: | 3.7849 |
logD: | 3.7849 |
logSw: | -4.223 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 57.463 |
InChI Key: | DJVANEYWEGJJFP-UHFFFAOYSA-N |