4-(3-{[5-(2,7-dimethoxynaphthalen-1-yl)-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid

Chemical Structure Depiction of
4-(3-{[5-(2,7-dimethoxynaphthalen-1-yl)-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
Available: 2 mg
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mg
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Compound characteristics

Compound ID: 3184-1266
Compound Name: 4-(3-{[5-(2,7-dimethoxynaphthalen-1-yl)-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
Molecular Weight: 651.74
Molecular Formula: C36 H33 N3 O7 S
Smiles: CCOC(C1C(c2c(ccc3ccc(cc23)OC)OC)N2C(=NC=1C)SC(=C/c1cc(C)n(c3ccc(cc3)C(O)=O)c1C)\C2=O)=O
Stereo: RACEMIC MIXTURE
logP: 6.4759
logD: 3.5897
logSw: -5.9921
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 1
Polar surface area: 91.723
InChI Key: LFWYATFUIDFYCM-JGCGQSQUSA-N
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