3,5-dinitro-N-(2,2,2-trichloro-1-{[(2-methylphenyl)carbamothioyl]amino}ethyl)benzamide

Chemical Structure Depiction of
3,5-dinitro-N-(2,2,2-trichloro-1-{[(2-methylphenyl)carbamothioyl]amino}ethyl)benzamide
Available: 36 mg
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mg
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Compound characteristics

Compound ID: 1309-0759
Compound Name: 3,5-dinitro-N-(2,2,2-trichloro-1-{[(2-methylphenyl)carbamothioyl]amino}ethyl)benzamide
Molecular Weight: 506.75
Molecular Formula: C17 H14 Cl3 N5 O5 S
Smiles: Cc1ccccc1NC(NC(C([Cl])([Cl])[Cl])NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)=S
Stereo: RACEMIC MIXTURE
logP: 4.1607
logD: 1.1738
logSw: -4.5489
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 3
Polar surface area: 109.425
InChI Key: VDLAIKSVPAQVAD-HNNXBMFYSA-N
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