2-{[1-(4-methyl-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid

Chemical Structure Depiction of
2-{[1-(4-methyl-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
Available: 3 mg
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mg
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Compound characteristics

Compound ID: 4676-0750
Compound Name: 2-{[1-(4-methyl-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
Molecular Weight: 386.38
Molecular Formula: C18 H14 N2 O6 S
Smiles: Cc1ccc(c(c1)[N+]([O-])=O)N1C(CC(C1=O)Sc1ccccc1C(O)=O)=O
Stereo: RACEMIC MIXTURE
logP: 2.4919
logD: -0.1195
logSw: -2.7539
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 1
Polar surface area: 90.345
InChI Key: FPTHAWWRKWQGQR-HNNXBMFYSA-N
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