(2E,4E)-2,4-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-8-methyl-8-azabicyclo[3.2.1]octan-3-one
Chemical Structure Depiction of
(2E,4E)-2,4-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-8-methyl-8-azabicyclo[3.2.1]octan-3-one
(2E,4E)-2,4-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-8-methyl-8-azabicyclo[3.2.1]octan-3-one
Compound characteristics
| Compound ID: | C151-0869 |
| Compound Name: | (2E,4E)-2,4-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-8-methyl-8-azabicyclo[3.2.1]octan-3-one |
| Molecular Weight: | 535.65 |
| Molecular Formula: | C32 H33 N5 O3 |
| Smiles: | CN1C2CCC1/C(=C\c1ccc(c(Cn3cccn3)c1)OC)C(C/2=C\c1ccc(c(Cn2cccn2)c1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2676 |
| logD: | 4.2638 |
| logSw: | -4.4018 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.769 |
| InChI Key: | UNWHQICVOSOHDU-UHFFFAOYSA-N |