benzyl (2,2,2-trichloro-1-{[(2-methoxy-5-nitrophenyl)carbamothioyl]amino}ethyl)carbamate

Chemical Structure Depiction of
benzyl (2,2,2-trichloro-1-{[(2-methoxy-5-nitrophenyl)carbamothioyl]amino}ethyl)carbamate
Available: 22 mg
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mg
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Compound characteristics

Compound ID: 0437-0093
Compound Name: benzyl (2,2,2-trichloro-1-{[(2-methoxy-5-nitrophenyl)carbamothioyl]amino}ethyl)carbamate
Molecular Weight: 507.78
Molecular Formula: C18 H17 Cl3 N4 O5 S
Smiles: COc1ccc(cc1NC(NC(C([Cl])([Cl])[Cl])NC(=O)OCc1ccccc1)=S)[N+]([O-])=O
Stereo: RACEMIC MIXTURE
logP: 4.8904
logD: 4.6833
logSw: -5.0689
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 3
Polar surface area: 92.131
InChI Key: GXGAZZDVCYPSHO-HNNXBMFYSA-N
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