1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | J078-0621 |
| Compound Name: | 1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 474.33 |
| Molecular Formula: | C22 H21 Br F N3 O3 |
| Smiles: | CCN(CC)C(C1=CC(N(CC(Nc2ccc(cc2F)[Br])=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0033 |
| logD: | 2.9946 |
| logSw: | -3.571 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.002 |
| InChI Key: | FLGRUVCAARKLFX-UHFFFAOYSA-N |