Vitas-M small molecule compound

2-{[6-(azepan-1-ylmethyl)-4-oxo-4H-pyran-3-yl]oxy}-N-(2-fluorobenzyl)acetamide

Catalog ID
STL309902
SMILES O=C(NCc1ccccc1F)COc1coc(cc1=O)CN1CCCCCC1

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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 C21H25FN2O4 MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25FN2O4/c22-18-8-4-3-7-16(18)12-23-21(26)15-28-20-14-27-17(11-19(20)25)13-24-9-5-1-2-6-10-24/h3-4,7-8,11,14H,1-2,5-6,9-10,12-13,15H2,(H,23,26)
InChIKey
UIXPPHRCIGDVNX-UHFFFAOYSA-N
Synonyms
1574311-13-9
1574311139
2((6(azepan1ylmethyl)4oxo4Hpyran3yl)oxy)N(2fluorobenzyl)acetamide
2(6(azepan1ylmethyl)4oxopyran3yl)oxyN((2fluorophenyl)methyl)acetamide
C1CCCN(CC1)CC2=CC(=O)C(=CO2)OCC(=O)NCC3=CC=CC=C3F
InChI=1SC21H25FN2O4c2218843716(18)122321(26)152820142717(1119(20)25)1324951261024h34781114H1256910121315H2(H2326)
MFCD28025211
ZINC000095472935
ZINC95472935

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Available files

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