2,6-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-4-methylcyclohexan-1-one
Chemical Structure Depiction of
2,6-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-4-methylcyclohexan-1-one
2,6-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-4-methylcyclohexan-1-one
Compound characteristics
| Compound ID: | C151-0772 |
| Compound Name: | 2,6-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)-4-methylcyclohexan-1-one |
| Molecular Weight: | 508.62 |
| Molecular Formula: | C31 H32 N4 O3 |
| Smiles: | CC1C/C(=C\c2ccc(c(Cn3cccn3)c2)OC)C(C(\C1)=C\c1ccc(c(Cn2cccn2)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8959 |
| logD: | 4.8959 |
| logSw: | -4.6808 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.341 |
| InChI Key: | BNEMXARPWRBAHT-UHFFFAOYSA-N |