Vitas-M small molecule compound

3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl morpholine-4-carboxylate

Catalog ID
STK655396
SMILES O=C(N1CCOCC1)Oc1ccc2c(c1)onc2c1cc(F)c(c(c1)F)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 C18H13F3N2O4 MW 378.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13F3N2O4/c19-13-7-10(8-14(20)16(13)21)17-12-2-1-11(9-15(12)27-22-17)26-18(24)23-3-5-25-6-4-23/h1-2,7-9H,3-6H2
InChIKey
PCJVAHFUXVEVTC-UHFFFAOYSA-N
Synonyms
1144497-32-4
(3(345trifluorophenyl)12benzoxazol6yl)morpholine4carboxylate
1144497324
3(345trifluorophenyl)12benzoxazol6ylmorpholine4carboxylate
3(345trifluorophenyl)benzo(d)isoxazol6ylmorpholine4carboxylate
C1COCCN1C(=O)OC2=CC3=C(C=C2)C(=NO3)C4=CC(=C(C(=C4)F)F)F
InChI=1SC18H13F3N2O4c1913710(814(20)16(13)21)17122111(915(12)272217)2618(24)2335256423h1279H36H2
MFCD12213066
ZINC000032089410
ZINC32089410

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Available files

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