Vitas-M small molecule compound
3-{2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-2-oxoethyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Catalog ID
STL409737
SMILES COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)N1CCC(CC1)c1noc2c1ccc(c2)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 C26H26FN3O5 MW 479.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26FN3O5/c1-33-22-11-17-7-10-30(24(31)13-18(17)12-23(22)34-2)15-25(32)29-8-5-16(6-9-29)26-20-4-3-19(27)14-21(20)35-28-26/h3-4,7,10-12,14,16H,5-6,8-9,13,15H2,1-2H3InChIKey
WVGCYWRVGIJKOG-UHFFFAOYSA-NSynonyms
1574399-83-91574399839
3(2(4(6fluoro12benzoxazol3yl)piperidin1yl)2oxoethyl)78dimethoxy13dihydro2H3benzazepin2one
3(2(4(6fluoro12benzoxazol3yl)piperidin1yl)2oxoethyl)78dimethoxy1H3benzazepin2one
3(2(4(6fluorobenzo(d)isoxazol3yl)piperidin1yl)2oxoethyl)78dimethoxy1Hbenzo(d)azepin2(3H)one
COC1=C(C=C2C=CN(C(=O)CC2=C1)CC(=O)N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F)OC
InChI=1SC26H26FN3O5c13322111771030(24(31)1318(17)1223(22)342)1525(32)298516(6929)26204319(27)1421(20)352826h34710121416H56891315H212H3
MFCD28059259
ZINC000096232295
ZINC96232295
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