5-[4-(3-chlorophenyl)piperazin-1-yl]-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-[4-(3-chlorophenyl)piperazin-1-yl]-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-[4-(3-chlorophenyl)piperazin-1-yl]-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-0921 |
| Compound Name: | 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 488.97 |
| Molecular Formula: | C27 H25 Cl N4 O3 |
| Smiles: | Cc1ccc(cc1C)OCc1ccc(c2nc(C#N)c(N3CCN(CC3)c3cccc(c3)[Cl])o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.5449 |
| logD: | 6.5449 |
| logSw: | -6.3863 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 58.084 |
| InChI Key: | ORHNEYGAQGPBLF-UHFFFAOYSA-N |