8-fluoro-2-({[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-4(1H)-one
Chemical Structure Depiction of
8-fluoro-2-({[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-4(1H)-one
8-fluoro-2-({[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-4(1H)-one
Compound characteristics
Compound ID: | G751-2085 |
Compound Name: | 8-fluoro-2-({[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-4(1H)-one |
Molecular Weight: | 380.44 |
Molecular Formula: | C20 H17 F N4 O S |
Smiles: | Cc1ccc(cc1)c1nnc(n1C)SCC1=CC(c2cccc(c2N1)F)=O |
Stereo: | ACHIRAL |
logP: | 3.9729 |
logD: | 3.7123 |
logSw: | -4.1331 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.593 |
InChI Key: | AUMDQWJNKMKRQV-UHFFFAOYSA-N |