N-{1-[2-(3,5-dinitrobenzoyl)-3-(2-hydroxyphenyl)diaziridin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-methylbenzene-1-sulfonamide

Chemical Structure Depiction of
N-{1-[2-(3,5-dinitrobenzoyl)-3-(2-hydroxyphenyl)diaziridin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-methylbenzene-1-sulfonamide
Available: 6 mg
Amount:
mg
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Compound characteristics

Compound ID: 8005-4991
Compound Name: N-{1-[2-(3,5-dinitrobenzoyl)-3-(2-hydroxyphenyl)diaziridin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-methylbenzene-1-sulfonamide
Molecular Weight: 631.62
Molecular Formula: C30 H25 N5 O9 S
Smiles: Cc1ccc(cc1)S(NC(Cc1ccccc1)C(N1C(c2ccccc2O)N1C(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)=O)(=O)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 5.1172
logD: 5.1161
logSw: -4.7227
Hydrogen bond acceptors count: 18
Hydrogen bond donors count: 2
Polar surface area: 158.934
InChI Key: JBKRFBGYALAVAK-UHFFFAOYSA-N
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