Vitas-M small molecule compound
3-chloro-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Catalog ID
STK343736
SMILES COc1cc(ccc1OC)c1cc(n2c(n1)c(Cl)c(n2)C(=O)O)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H11ClF3N3O4 MW 401.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClF3N3O4/c1-26-9-4-3-7(5-10(9)27-2)8-6-11(16(18,19)20)23-14(21-8)12(17)13(22-23)15(24)25/h3-6H,1-2H3,(H,24,25)InChIKey
FMHAKAVUCNNDMV-UHFFFAOYSA-NSynonyms
312922-10-4312922104
3chloro5(34dimethoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxylicacid
5(34DIMETHOXYPHENYL)3CHLORO7(TRIFLUOROMETHYL)8HYDROPYRAZOLO(15A)PYRIMIDINE2CARBOXYLICACID
COC1=C(C=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(F)(F)F)C(=O)O)Cl)OC
InChI=1SC16H11ClF3N3O4c1269437(510(9)272)8611(16(1819)20)2314(218)12(17)13(2223)15(24)25h36H12H3(H2425)
MFCD01529193
ZINC000000848629
ZINC848629
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