2-methyl-N-(3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide

Chemical Structure Depiction of
2-methyl-N-(3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Available: 56 mg
Amount:
mg
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Compound characteristics

Compound ID: E532-0868
Compound Name: 2-methyl-N-(3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Molecular Weight: 491.53
Molecular Formula: C24 H24 F3 N3 O3 S
Smiles: CC1=C(C(Nc2cccc(c2)C(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)=O)SCCO1
Stereo: ACHIRAL
logP: 3.2924
logD: 3.291
logSw: -3.5901
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 51.509
InChI Key: AOQMWHVPZDBOLP-UHFFFAOYSA-N
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