Vitas-M small molecule compound

ethyl 2-(4-{[(diethoxyphosphoryl)(4-methoxyphenyl)methyl]amino}-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate

Catalog ID
STK526926
SMILES CCOP(=O)(C(c1ccc(cc1)OC)Nc1ccc(cc1C)C(C(F)(F)F)(C(=O)OCC)O)OCC

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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 C24H31F3NO7P MW 533.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31F3NO7P/c1-6-33-22(29)23(30,24(25,26)27)18-11-14-20(16(4)15-18)28-21(36(31,34-7-2)35-8-3)17-9-12-19(32-5)13-10-17/h9-15,21,28,30H,6-8H2,1-5H3
InChIKey
CDVLMJNFOLYHDG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C(C1=CC(=C(C=C1)NC(C2=CC=C(C=C2)OC)P(=O)(OCC)OCC)C)(C(F)(F)F)O
ethyl2(4(((diethoxyphosphoryl)(4methoxyphenyl)methyl)amino)3methylphenyl)333trifluoro2hydroxypropanoate
ETHYL2(4((DIETHOXYPHOSPHORYL(4METHOXYPHENYL)METHYL)AMINO)3METHYLPHENYL)333TRIFLUORO2HYDROXYPROPANOATE
InChI=1SC24H31F3NO7Pc163322(29)23(3024(2526)27)18111420(16(4)1518)2821(36(313472)3583)1791219(325)131017h915212830H68H215H3
MFCD00788922
ZINC000097949531
ZINC000097949534

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Available files

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