5-[4-(3-methylbenzoyl)piperazin-1-yl]-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-[4-(3-methylbenzoyl)piperazin-1-yl]-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-[4-(3-methylbenzoyl)piperazin-1-yl]-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D366-0131 |
| Compound Name: | 5-[4-(3-methylbenzoyl)piperazin-1-yl]-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C28 H26 N4 O4 |
| Smiles: | Cc1cccc(c1)C(N1CCN(CC1)c1c(C#N)nc(c2ccc(COc3ccccc3C)o2)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8426 |
| logD: | 4.8426 |
| logSw: | -4.7653 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.366 |
| InChI Key: | DBINNQQLRNJEET-UHFFFAOYSA-N |