4-bromo-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide
Chemical Structure Depiction of
4-bromo-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide
4-bromo-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | D679-0042 |
| Compound Name: | 4-bromo-N-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}benzamide |
| Molecular Weight: | 324.17 |
| Molecular Formula: | C13 H14 Br N3 O2 |
| Smiles: | CC(C)c1nc(CNC(c2ccc(cc2)[Br])=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.35 |
| logD: | 3.35 |
| logSw: | -3.4645 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.591 |
| InChI Key: | YHNXIAYYMFEDEW-UHFFFAOYSA-N |