N-(2-fluorophenyl)-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
N-(2-fluorophenyl)-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Compound characteristics
| Compound ID: | S747-0213 |
| Compound Name: | N-(2-fluorophenyl)-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C21 H28 F N5 O3 |
| Smiles: | CC(C)c1nc(C2CCCN(CCC(NCC2)=O)C(Nc2ccccc2F)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5225 |
| logD: | 2.5225 |
| logSw: | -2.9014 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.042 |
| InChI Key: | VTZWQKGMCXRXND-HNNXBMFYSA-N |