N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-5-(4-bromophenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-5-(4-bromophenyl)-1,2-oxazole-3-carboxamide
N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-5-(4-bromophenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | D459-0132 |
| Compound Name: | N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-5-(4-bromophenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 474.42 |
| Molecular Formula: | C22 H24 Br N3 O2 S |
| Smiles: | C1CCCN(CC1)C(CNC(c1cc(c2ccc(cc2)[Br])on1)=O)c1cccs1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2649 |
| logD: | 4.9897 |
| logSw: | -5.3825 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.526 |
| InChI Key: | NXBOPWZYVXVNJR-IBGZPJMESA-N |