5-(4-benzylpiperidin-1-yl)-2-[(4-bromophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(4-benzylpiperidin-1-yl)-2-[(4-bromophenoxy)methyl]-1,3-oxazole-4-carbonitrile
5-(4-benzylpiperidin-1-yl)-2-[(4-bromophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | 5677-0217 |
| Compound Name: | 5-(4-benzylpiperidin-1-yl)-2-[(4-bromophenoxy)methyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 452.35 |
| Molecular Formula: | C23 H22 Br N3 O2 |
| Smiles: | C1CN(CCC1Cc1ccccc1)c1c(C#N)nc(COc2ccc(cc2)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 6.0622 |
| logD: | 6.0622 |
| logSw: | -6.1002 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 46.648 |
| InChI Key: | ORLMRZGNAFXDHH-UHFFFAOYSA-N |