Vitas-M small molecule compound

methyl N-acetyl-3,3,3-trifluoro-2-[(5-methylpyridin-2-yl)amino]alaninate

Catalog ID
STK765800
SMILES COC(=O)C(C(F)(F)F)(Nc1ccc(cn1)C)NC(=O)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 C12H14F3N3O3 MW 305.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14F3N3O3/c1-7-4-5-9(16-6-7)18-11(10(20)21-3,12(13,14)15)17-8(2)19/h4-6H,1-3H3,(H,16,18)(H,17,19)
InChIKey
NLHBGCHKKKDCBD-UHFFFAOYSA-N
Synonyms
447411-01-0
(R)methyl2acetamido333trifluoro2((5methylpyridin2yl)amino)propanoate
2ACETAMIDO333TRIFLUORO2((5METHYL2PYRIDINYL)AMINO)PROPANOICACIDMETHYLESTER
2ACETAMIDO333TRIFLUORO2((5METHYL2PYRIDYL)AMINO)PROPIONICACIDMETHYLESTER
2ACETYLAMINO333TRIFLUORO2(5METHYLPYRIDIN2YLAMINO)PROPIONICACIDMETHYLESTER
447411010
CC1=CN=C(C=C1)NC(C(=O)OC)(C(F)(F)F)NC(=O)C
InChI=1SC12H14F3N3O3c17459(1667)1811(10(20)21312(1314)15)178(2)19h46H13H3(H1618)(H1719)
METHYL2(ACETYLAMINO)333TRIFLUORO2((5METHYL2PYRIDINYL)AMINO)PROPANOATE
METHYL2(ACETYLAMINO)333TRIFLUORON(5METHYLPYRIDIN2YL)DALANINATE
METHYL2(ACETYLAMINO)333TRIFLUORON(5METHYLPYRIDIN2YL)LALANINATE
METHYL2ACETAMIDO333TRIFLUORO2((5METHYLPYRIDIN2YL)AMINO)PROPANOATE
METHYL2ACETAMIDO333TRIS(FLUORANYL)2((5METHYLPYRIDIN2YL)AMINO)PROPANOATE
methylNacetyl333trifluoro2((5methylpyridin2yl)amino)alaninate
MFCD02934152
ZINC000012462473
ZINC000012462474

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.