2-(2H-1,3-benzodioxol-5-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(2H-1,3-benzodioxol-5-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8002-9860 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-4-{[4-(propan-2-yl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 335.36 |
| Molecular Formula: | C20 H17 N O4 |
| Smiles: | CC(C)c1ccc(/C=C2/C(=O)OC(c3ccc4c(c3)OCO4)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5327 |
| logD: | 4.5327 |
| logSw: | -4.4023 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.491 |
| InChI Key: | IMMVBPRFCPEPJF-UHFFFAOYSA-N |