2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-0679 |
| Compound Name: | 2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-{[(oxolan-2-yl)methyl]amino}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 444.28 |
| Molecular Formula: | C20 H18 Br N3 O4 |
| Smiles: | C1CC(CNc2c(C#N)nc(c3ccc(COc4ccc(cc4)[Br])o3)o2)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9527 |
| logD: | 3.9527 |
| logSw: | -4.1022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.001 |
| InChI Key: | NUQLSVGEZZOSBT-OAHLLOKOSA-N |