2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | K074-5802 |
Compound Name: | 2-(4'-octyl[1,1'-biphenyl]-4-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
Molecular Weight: | 479.66 |
Molecular Formula: | C33 H37 N O2 |
Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)C1=NC(=C/c2ccc(cc2)C(C)C)\C(=O)O1 |
Stereo: | ACHIRAL |
logP: | 10.4713 |
logD: | 10.4713 |
logSw: | -5.8036 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 30.104 |
InChI Key: | NLHPEQUSRBGJAY-UHFFFAOYSA-N |