5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D301-0189 |
| Compound Name: | 5-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C25 H21 N3 O4 |
| Smiles: | COc1ccc(cc1)OCc1ccc(c2nc(C#N)c(N3CCc4ccccc4C3)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.0763 |
| logD: | 5.0763 |
| logSw: | -4.7654 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.029 |
| InChI Key: | FICBCXDTRKGGSB-UHFFFAOYSA-N |