Vitas-M small molecule compound

1,2,4-trifluoro-3-(piperidin-1-yl)dibenzo[b,f][1,4]oxazepine

Catalog ID
STK756265
SMILES Fc1c2C=Nc3c(Oc2c(c(c1F)N1CCCCC1)F)cccc3

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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 C18H15F3N2O MW 332.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F3N2O/c19-14-11-10-22-12-6-2-3-7-13(12)24-18(11)16(21)17(15(14)20)23-8-4-1-5-9-23/h2-3,6-7,10H,1,4-5,8-9H2
InChIKey
XNPFKXMILAQRFR-UHFFFAOYSA-N
Synonyms

124trifluoro3(piperidin1yl)dibenzo(bf)(14)oxazepine
124TRIFLUORO3PIPERIDYLDIBENZO(BF)14OXAZEPINE
7810trifluoro9piperidin1ylbenzo(b)(14)benzoxazepine
C1CCN(CC1)C2=C(C3=C(C=NC4=CC=CC=C4O3)C(=C2F)F)F
InChI=1SC18H15F3N2Oc191411102212623713(12)2418(11)16(21)17(15(14)20)238415923h236710H14589H2
MFCD00388766
ZINC000004455845
ZINC04455845
ZINC4455845

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Available files

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