N-[(2-chloro-4-fluorophenyl)methyl]-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
N-[(2-chloro-4-fluorophenyl)methyl]-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Compound characteristics
| Compound ID: | C498-0689 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide |
| Molecular Weight: | 400.86 |
| Molecular Formula: | C20 H14 Cl F N2 O2 S |
| Smiles: | CN1C(c2cc(C(NCc3ccc(cc3[Cl])F)=O)sc2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4023 |
| logD: | 4.4023 |
| logSw: | -4.5385 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.539 |
| InChI Key: | JBCRWXDVFWVBTN-UHFFFAOYSA-N |