5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D301-0291 |
| Compound Name: | 5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(2-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C25 H21 N3 O3 |
| Smiles: | Cc1ccccc1OCc1ccc(c2nc(C#N)c(N3CCc4ccccc4C3)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.5686 |
| logD: | 5.5686 |
| logSw: | -5.6088 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.572 |
| InChI Key: | WPJFPLRZXDAPGC-UHFFFAOYSA-N |