4-benzylidene-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-benzylidene-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one
4-benzylidene-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0531 |
| Compound Name: | 4-benzylidene-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 313.74 |
| Molecular Formula: | C17 H12 Cl N O3 |
| Smiles: | COc1ccc(C2=NC(=C/c3ccccc3)\C(=O)O2)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.881 |
| logD: | 3.881 |
| logSw: | -4.5754 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.919 |
| InChI Key: | MAWSCMNLZMNXPI-UHFFFAOYSA-N |