5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-1-(3-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Chemical Structure Depiction of
5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-1-(3-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Available: 113 mg
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mg
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Compound characteristics

Compound ID: 4998-1414
Compound Name: 5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-1-(3-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Molecular Weight: 420.46
Molecular Formula: C22 H17 F N4 O2 S
Smiles: Cc1cc(\C=C2/C(NC(N(C2=O)c2cccc(c2)F)=S)=O)c(C)n1c1cccnc1
Stereo: ACHIRAL
logP: 2.5324
logD: 2.001
logSw: -2.5713
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 52.411
InChI Key: WISOJRVDPMKGJR-UHFFFAOYSA-N
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