N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
Compound characteristics
| Compound ID: | C498-0691 |
| Compound Name: | N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-5-methyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide |
| Molecular Weight: | 464.56 |
| Molecular Formula: | C25 H25 F N4 O2 S |
| Smiles: | CN1C(c2cc(C(NCCN3CCN(CC3)c3ccccc3F)=O)sc2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3607 |
| logD: | 3.3408 |
| logSw: | -3.9022 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.322 |
| InChI Key: | SWSMJJPQHJNWMD-UHFFFAOYSA-N |