3-[5-({2-[(2-hydroxyethyl)amino]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Chemical Structure Depiction of
3-[5-({2-[(2-hydroxyethyl)amino]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
Available: 75 mg
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mg
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Compound characteristics

Compound ID: 4578-0126
Compound Name: 3-[5-({2-[(2-hydroxyethyl)amino]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
Molecular Weight: 434.49
Molecular Formula: C18 H18 N4 O5 S2
Smiles: CC1=CC=CN2C1=NC(=C(/C=C1/C(N(CCC(O)=O)C(=S)S1)=O)C2=O)NCCO
Stereo: ACHIRAL
logP: -0.4801
logD: -3.0127
logSw: -1.3244
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 3
Polar surface area: 95.608
InChI Key: FEWHBQVADVMZJK-UHFFFAOYSA-N
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