1-(4-fluorobenzoyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
Chemical Structure Depiction of
1-(4-fluorobenzoyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
1-(4-fluorobenzoyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
Compound characteristics
Compound ID: | J042-0753 |
Compound Name: | 1-(4-fluorobenzoyl)-N-[3-(methylsulfanyl)phenyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide |
Molecular Weight: | 420.5 |
Molecular Formula: | C24 H21 F N2 O2 S |
Smiles: | CSc1cccc(c1)NC(c1ccc2c(CCCN2C(c2ccc(cc2)F)=O)c1)=O |
Stereo: | ACHIRAL |
logP: | 4.835 |
logD: | 4.8345 |
logSw: | -4.5597 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.642 |
InChI Key: | WMLOGRWNVQKJIA-UHFFFAOYSA-N |