2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazole-4-carbonitrile
2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-0972 |
| Compound Name: | 2-{5-[(2-chlorophenoxy)methyl]furan-2-yl}-5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 431.88 |
| Molecular Formula: | C24 H18 Cl N3 O3 |
| Smiles: | C1CN(Cc2ccccc12)c1c(C#N)nc(c2ccc(COc3ccccc3[Cl])o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.4886 |
| logD: | 5.4886 |
| logSw: | -6.0783 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.572 |
| InChI Key: | RCWYTHRWCAFDQY-UHFFFAOYSA-N |