5-bromo-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}pyridine-3-carboxamide
Chemical Structure Depiction of
5-bromo-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}pyridine-3-carboxamide
5-bromo-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | 5524-0030 |
| Compound Name: | 5-bromo-N-{4-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}pyridine-3-carboxamide |
| Molecular Weight: | 436.31 |
| Molecular Formula: | C22 H18 Br N3 O2 |
| Smiles: | CC(C)c1ccc2c(c1)nc(c1ccc(cc1)NC(c1cc(cnc1)[Br])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.5348 |
| logD: | 5.5343 |
| logSw: | -5.312 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.747 |
| InChI Key: | WNUTYTYYKGVWJY-UHFFFAOYSA-N |