2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-[(butan-2-yl)amino]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-[(butan-2-yl)amino]-1,3-oxazole-4-carbonitrile
2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-[(butan-2-yl)amino]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-0499 |
| Compound Name: | 2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-[(butan-2-yl)amino]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 416.27 |
| Molecular Formula: | C19 H18 Br N3 O3 |
| Smiles: | CCC(C)Nc1c(C#N)nc(c2ccc(COc3ccc(cc3)[Br])o2)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9152 |
| logD: | 4.9152 |
| logSw: | -4.5622 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.06 |
| InChI Key: | FLLFLLSFFOUUKV-LBPRGKRZSA-N |