3-benzyl-4-{[4-(pyrrolidin-1-yl)phenyl]methylidene}-1,2-oxazol-5(4H)-one
Chemical Structure Depiction of
3-benzyl-4-{[4-(pyrrolidin-1-yl)phenyl]methylidene}-1,2-oxazol-5(4H)-one
3-benzyl-4-{[4-(pyrrolidin-1-yl)phenyl]methylidene}-1,2-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8018-8424 |
| Compound Name: | 3-benzyl-4-{[4-(pyrrolidin-1-yl)phenyl]methylidene}-1,2-oxazol-5(4H)-one |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C21 H20 N2 O2 |
| Smiles: | C1CCN(C1)c1ccc(/C=C2/C(Cc3ccccc3)=NOC2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1805 |
| logD: | 4.1805 |
| logSw: | -4.2629 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.413 |
| InChI Key: | JTKCJEZZVURAFA-UHFFFAOYSA-N |