2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-5-[(propan-2-yl)amino]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-5-[(propan-2-yl)amino]-1,3-oxazole-4-carbonitrile
2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-5-[(propan-2-yl)amino]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-1041 |
| Compound Name: | 2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-5-[(propan-2-yl)amino]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C20 H21 N3 O3 |
| Smiles: | CC(C)Nc1c(C#N)nc(c2ccc(COc3ccc(C)c(C)c3)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.7863 |
| logD: | 4.7863 |
| logSw: | -4.5533 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.592 |
| InChI Key: | RKGFBTGGIDSPKG-UHFFFAOYSA-N |