2-[2-(4-chlorophenyl)ethenyl]-5-{4-[(4-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[2-(4-chlorophenyl)ethenyl]-5-{4-[(4-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
2-[2-(4-chlorophenyl)ethenyl]-5-{4-[(4-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D465-0093 |
| Compound Name: | 2-[2-(4-chlorophenyl)ethenyl]-5-{4-[(4-methylphenoxy)acetyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 462.94 |
| Molecular Formula: | C25 H23 Cl N4 O3 |
| Smiles: | Cc1ccc(cc1)OCC(N1CCN(CC1)c1c(C#N)nc(/C=C/c2ccc(cc2)[Cl])o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5854 |
| logD: | 4.5854 |
| logSw: | -4.9548 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.848 |
| InChI Key: | MCTRVOOKLUAUMR-UHFFFAOYSA-N |