4-benzylidene-2-(5-bromo-2-methoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-benzylidene-2-(5-bromo-2-methoxyphenyl)-1,3-oxazol-5(4H)-one
4-benzylidene-2-(5-bromo-2-methoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0741 |
| Compound Name: | 4-benzylidene-2-(5-bromo-2-methoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 358.19 |
| Molecular Formula: | C17 H12 Br N O3 |
| Smiles: | COc1ccc(cc1C1=NC(=C/c2ccccc2)\C(=O)O1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9416 |
| logD: | 3.9416 |
| logSw: | -4.1003 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.006 |
| InChI Key: | BUIDLGZZTAHBSW-UHFFFAOYSA-N |