2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-0682 |
| Compound Name: | 2-{5-[(2,5-dimethylphenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C22 H23 N3 O4 |
| Smiles: | Cc1ccc(C)c(c1)OCc1ccc(c2nc(C#N)c(NCC3CCCO3)o2)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0414 |
| logD: | 4.0414 |
| logSw: | -4.0504 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.088 |
| InChI Key: | URXGAUDNPJGBOR-MRXNPFEDSA-N |