2,5-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)cyclopentan-1-one
Chemical Structure Depiction of
2,5-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)cyclopentan-1-one
2,5-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)cyclopentan-1-one
Compound characteristics
| Compound ID: | C151-0680 |
| Compound Name: | 2,5-bis({4-methoxy-3-[(1H-pyrazol-1-yl)methyl]phenyl}methylidene)cyclopentan-1-one |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C29 H28 N4 O3 |
| Smiles: | COc1ccc(\C=C2/CC/C(=C\c3ccc(c(Cn4cccn4)c3)OC)C2=O)cc1Cn1cccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.9818 |
| logD: | 3.9818 |
| logSw: | -4.1042 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.707 |
| InChI Key: | WCIHYANSSPDYMO-UHFFFAOYSA-N |