2-[2-(2-chlorophenyl)ethenyl]-5-{4-[(3-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[2-(2-chlorophenyl)ethenyl]-5-{4-[(3-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
2-[2-(2-chlorophenyl)ethenyl]-5-{4-[(3-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D465-0202 |
| Compound Name: | 2-[2-(2-chlorophenyl)ethenyl]-5-{4-[(3-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 462.94 |
| Molecular Formula: | C25 H23 Cl N4 O3 |
| Smiles: | Cc1cccc(c1)OCC(N1CCN(CC1)c1c(C#N)nc(/C=C/c2ccccc2[Cl])o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5892 |
| logD: | 4.5892 |
| logSw: | -4.6056 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.848 |
| InChI Key: | KWMVVGDMIHUSKX-UHFFFAOYSA-N |