Vitas-M small molecule compound
6,8-dibromo-7-hydroxy-10a-(piperidin-1-yl)-2,3,4,5,5a,10a-hexahydro-1H-[1]benzofuro[2,3-c]azepin-1-one
Catalog ID
STK554161
SMILES O=C1NCCCC2C1(Oc1c2c(Br)c(c(c1)Br)O)N1CCCCC1
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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 C17H20Br2N2O3 MW 460.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20Br2N2O3/c18-11-9-12-13(14(19)15(11)22)10-5-4-6-20-16(23)17(10,24-12)21-7-2-1-3-8-21/h9-10,22H,1-8H2,(H,20,23)InChIKey
NITFWLKPVKKRHZ-UHFFFAOYSA-NSynonyms
454196-88-4454196884
68dibromo7hydroxy10a(piperidin1yl)23455a10ahexahydro1H(1)benzofuro(23c)azepin1one
68dibromo7hydroxy10a(piperidin1yl)23455a10ahexahydro1Hbenzofuro(23c)azepin1one
68dibromo7hydroxy10apiperidin1yl3455atetrahydro2H(1)benzofuro(23c)azepin1one
C1CCN(CC1)C23C(CCCNC2=O)C4=C(C(=C(C=C4O3)Br)O)Br
InChI=1SC17H20Br2N2O3c181191213(14(19)15(11)22)105462016(23)17(102412)217213821h91022H18H2(H2023)
MFCD03010696
ZINC000057063901
ZINC000057063904
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