5-[4-(2-chlorobenzoyl)piperazin-1-yl]-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-[4-(2-chlorobenzoyl)piperazin-1-yl]-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
5-[4-(2-chlorobenzoyl)piperazin-1-yl]-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D465-0260 |
| Compound Name: | 5-[4-(2-chlorobenzoyl)piperazin-1-yl]-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 478.93 |
| Molecular Formula: | C25 H23 Cl N4 O4 |
| Smiles: | COc1ccc(/C=C/c2nc(C#N)c(N3CCN(CC3)C(c3ccccc3[Cl])=O)o2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.906 |
| logD: | 3.906 |
| logSw: | -4.2874 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.137 |
| InChI Key: | UUNINLBCNYNDSE-UHFFFAOYSA-N |