Vitas-M small molecule compound

propan-2-yl 2-amino-4-(2,4-difluorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate

Catalog ID
STK688727
SMILES OCc1cc(=O)c2c(o1)C(C(=C(O2)N)C(=O)OC(C)C)c1ccc(cc1F)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 C19H17F2NO6 MW 393.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17F2NO6/c1-8(2)26-19(25)15-14(11-4-3-9(20)5-12(11)21)17-16(28-18(15)22)13(24)6-10(7-23)27-17/h3-6,8,14,23H,7,22H2,1-2H3
InChIKey
NKFMIGLYXIGPHA-UHFFFAOYSA-N
Synonyms

CC(C)OC(=O)C1=C(OC2=C(C1C3=C(C=C(C=C3)F)F)OC(=CC2=O)CO)N
InChI=1SC19H17F2NO6c18(2)2619(25)1514(11439(20)512(11)21)1716(2818(15)22)13(24)610(723)2717h3681423H722H212H3
ISOPROPYL2AMINO4(24DIFLUOROPHENYL)6(HYDROXYMETHYL)8OXO48DIHYDROPYRANO(32B)PYRAN3CARBOXYLATE
METHYLETHYL2AMINO4(24DIFLUOROPHENYL)6(HYDROXYMETHYL)8OXO4HPYRANO(32B)PYRAN3CARBOXYLATE
MFCD07658515
propan2yl2amino4(24difluorophenyl)6(hydroxymethyl)8oxo48dihydropyrano(32b)pyran3carboxylate
PROPAN2YL2AMINO4(24DIFLUOROPHENYL)6(HYDROXYMETHYL)8OXO4HPYRANO(32B)PYRAN3CARBOXYLATE
ZINC000004784041
ZINC000100218180

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Available files

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