Vitas-M small molecule compound
1-[4-(difluoromethyl)-6-(1,3-dimethyl-1H-pyrazol-4-yl)pyrimidin-2-yl]azepane
Catalog ID
STL413735
SMILES Cn1nc(c(c1)c1cc(nc(n1)N1CCCCCC1)C(F)F)C
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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 C16H21F2N5 MW 321.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21F2N5/c1-11-12(10-22(2)21-11)13-9-14(15(17)18)20-16(19-13)23-7-5-3-4-6-8-23/h9-10,15H,3-8H2,1-2H3InChIKey
UOAZSSYDLALDBK-UHFFFAOYSA-NSynonyms
1174855-84-51(4(difluoromethyl)6(13dimethyl1Hpyrazol4yl)pyrimidin2yl)azepane
1(4(difluoromethyl)6(13dimethylpyrazol4yl)pyrimidin2yl)azepane
1174855845
CC1=NN(C=C1C2=CC(=NC(=N2)N3CCCCCC3)C(F)F)C
InChI=1SC16H21F2N5c11112(1022(2)2111)13914(15(17)18)2016(1913)2375346823h91015H38H212H3
MFCD09475265
ZINC000036618663
ZINC36618663
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