3-methyl-4-({2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,2-oxazol-5(4H)-one
Chemical Structure Depiction of
3-methyl-4-({2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,2-oxazol-5(4H)-one
3-methyl-4-({2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,2-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 5408-2265 |
| Compound Name: | 3-methyl-4-({2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,2-oxazol-5(4H)-one |
| Molecular Weight: | 241.24 |
| Molecular Formula: | C14 H11 N O3 |
| Smiles: | CC1/C(=C\c2ccccc2OCC#C)C(=O)ON=1 |
| Stereo: | ACHIRAL |
| logP: | 2.3382 |
| logD: | 2.3382 |
| logSw: | -2.5704 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.64 |
| InChI Key: | WKKVRAPLZMFBJG-UHFFFAOYSA-N |