COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK798180
Chemical Name: methyl(2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-(4-ethoxy-3-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOc1ccc(cc1OC)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OC)C

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Saltdata: 1/3 CH3COOH
Molecular Weight: 552.6
Empirical Formula: C28H28N2O8S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 4.534
Rotatable bonds: 10
H-donors: 0
H-acceptors: 8
PSA: 138
Number of rings: 4

     

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