5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-[2-(4-methylphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-[2-(4-methylphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-[2-(4-methylphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D465-0048 |
| Compound Name: | 5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-[2-(4-methylphenyl)ethenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 432.91 |
| Molecular Formula: | C24 H21 Cl N4 O2 |
| Smiles: | Cc1ccc(/C=C/c2nc(C#N)c(N3CCN(CC3)C(c3cccc(c3)[Cl])=O)o2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7882 |
| logD: | 4.7882 |
| logSw: | -5.058 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.876 |
| InChI Key: | CLCJQWZEVXMUNW-UHFFFAOYSA-N |