Vitas-M small molecule compound

(2E)-2-(1,3-benzoxazol-2-yl)-3-(3-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

Catalog ID
STK897390
SMILES COc1cccc(c1)/C=C(/C(=O)c1cc(OC)c(c(c1)OC)OC)\c1nc2c(o1)cccc2

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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 C26H23NO6 MW 445.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO6/c1-29-18-9-7-8-16(12-18)13-19(26-27-20-10-5-6-11-21(20)33-26)24(28)17-14-22(30-2)25(32-4)23(15-17)31-3/h5-15H,1-4H3/b19-13-
InChIKey
XVPZVSNYEKASNZ-UYRXBGFRSA-N
Synonyms
496011-53-1
(2E)2(13benzoxazol2yl)3(3methoxyphenyl)1(345trimethoxyphenyl)prop2en1one
(2E)2BENZOXAZOL2YL3(3METHOXYPHENYL)1(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)3(3METHOXYPHENYL)1(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)2(benzo(d)oxazol2yl)3(3methoxyphenyl)1(345trimethoxyphenyl)prop2en1one
2(13BENZOXAZOL2YL)3(3METHOXYPHENYL)1(345TRIMETHOXYPHENYL)2PROPEN1ONE
496011531
COC1=CC=CC(=C1)C=C(C2=NC3=CC=CC=C3O2)C(=O)C4=CC(=C(C(=C4)OC)OC)OC
COc1cccc(c1)C=C(C(=O)c1cc(OC)c(c(c1)OC)OC)c1nc2c(o1)cccc2
InChI=1SC26H23NO6c1291897816(1218)1319(26272010561121(20)3326)24(28)171422(302)25(324)23(1517)313h515H14H3b1913
MFCD03498488
ZINC000008437054
ZINC08437054
ZINC8437054

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Available files

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