2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
Compound ID: | 8017-2540 |
Compound Name: | 2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide |
Molecular Weight: | 418.44 |
Molecular Formula: | C20 H17 F3 N4 O S |
Smiles: | C1CN2CCC1c1c2cc(C#N)c(n1)SCC(Nc1cccc(c1)C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 4.8165 |
logD: | 4.8158 |
logSw: | -4.7251 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.506 |
InChI Key: | BCAFVZUSWHMWMG-UHFFFAOYSA-N |