5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-{5-[(3-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-{5-[(3-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-{5-[(3-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D301-0228 |
| Compound Name: | 5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-{5-[(3-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C22 H21 N5 O3 |
| Smiles: | Cc1cccc(c1)OCc1ccc(c2nc(C#N)c(NCCCn3ccnc3)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.268 |
| logD: | 3.0261 |
| logSw: | -3.0413 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.989 |
| InChI Key: | LOKKBVMLPRCORV-UHFFFAOYSA-N |