N-[(2-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide
N-[(2-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide
Compound characteristics
| Compound ID: | M291-2368 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide |
| Molecular Weight: | 413.88 |
| Molecular Formula: | C22 H21 Cl F N3 O2 |
| Smiles: | CC(C)C(Nc1cc(C(NCc2ccc(cc2[Cl])F)=O)c2ccc(C)nc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4164 |
| logD: | 5.4162 |
| logSw: | -5.9338 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.152 |
| InChI Key: | VQKOVUODCBDXSM-UHFFFAOYSA-N |