6-chloro-2-({[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-4(1H)-one

Chemical Structure Depiction of
6-chloro-2-({[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-4(1H)-one
Available: 102 mg
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mg
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Compound characteristics

Compound ID: G751-1974
Compound Name: 6-chloro-2-({[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-4(1H)-one
Molecular Weight: 412.9
Molecular Formula: C20 H17 Cl N4 O2 S
Smiles: Cn1c(COc2ccccc2)nnc1SCC1=CC(c2cc(ccc2N1)[Cl])=O
Stereo: ACHIRAL
logP: 3.836
logD: 3.613
logSw: -4.2813
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 58.321
InChI Key: JVALONDFMFPSTG-UHFFFAOYSA-N
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