Vitas-M small molecule compound

1-(3-chloro-4-fluorophenyl)-6-[2-(trifluoromethyl)phenyl]-1,6-dihydro-1,3,5-triazine-2,4-diamine

Catalog ID
STK407003
SMILES NC1=NC(N(C(=N1)N)c1ccc(c(c1)Cl)F)c1ccccc1C(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 C16H12ClF4N5 MW 385.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClF4N5/c17-11-7-8(5-6-12(11)18)26-13(24-14(22)25-15(26)23)9-3-1-2-4-10(9)16(19,20)21/h1-7,13H,(H4,22,23,24,25)
InChIKey
CXBCZYCSJBKKLT-UHFFFAOYSA-N
Synonyms

1(3CHLORO4FLUOROPHENYL)2(2(TRIFLUOROMETHYL)PHENYL)2H135TRIAZINE46DIAMINE
1(3chloro4fluorophenyl)6(2(trifluoromethyl)phenyl)16dihydro135triazine24diamine
C1=CC=C(C(=C1)C2N=C(N=C(N2C3=CC(=C(C=C3)F)Cl)N)N)C(F)(F)F
InChI=1SC16H12ClF4N5c171178(5612(11)18)2613(2414(22)2515(26)23)9312410(9)16(1920)21h1713H(H422232425)
MFCD07613462
ZINC000015952204
ZINC000015952205

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Available files

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