Vitas-M small molecule compound
1-[4-(difluoromethyl)-6-(3,4-dimethoxyphenyl)pyrimidin-2-yl]piperidine-4-carboxylic acid
Catalog ID
STK315312
SMILES COc1cc(ccc1OC)c1cc(nc(n1)N1CCC(CC1)C(=O)O)C(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 C19H21F2N3O4 MW 393.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21F2N3O4/c1-27-15-4-3-12(9-16(15)28-2)13-10-14(17(20)21)23-19(22-13)24-7-5-11(6-8-24)18(25)26/h3-4,9-11,17H,5-8H2,1-2H3,(H,25,26)InChIKey
AVAISGAUYNOMTP-UHFFFAOYSA-NSynonyms
870260-43-81(4(difluoromethyl)6(34dimethoxyphenyl)pyrimidin2yl)piperidine4carboxylicacid
870260438
COC1=C(C=C(C=C1)C2=CC(=NC(=N2)N3CCC(CC3)C(=O)O)C(F)F)OC
InChI=1SC19H21F2N3O4c127154312(916(15)282)131014(17(20)21)2319(2213)247511(6824)18(25)26h3491117H58H212H3(H2526)
MFCD05861830
ZINC000002554254
ZINC2554254
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