Vitas-M small molecule compound
9-bromo-5-(3,4-dimethoxyphenyl)-2-[4-(prop-2-en-1-yloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK740062
SMILES C=CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC2c1ccc(c(c1)OC)OC
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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 C27H25BrN2O4 MW 521.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2O4/c1-4-13-33-20-9-5-17(6-10-20)22-16-23-21-15-19(28)8-12-24(21)34-27(30(23)29-22)18-7-11-25(31-2)26(14-18)32-3/h4-12,14-15,23,27H,1,13,16H2,2-3H3InChIKey
BBCQSHKNVAHLDY-UHFFFAOYSA-NSynonyms
384800-01-52(4(allyloxy)phenyl)9bromo5(34dimethoxyphenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
384800015
4(2BROMO9(4PROP2ENYLOXYPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL))12DIMETHOXYBENZENE
9bromo5(34dimethoxyphenyl)2(4(prop2en1yloxy)phenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9BROMO5(34DIMETHOXYPHENYL)2(4PROP2ENOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
COC1=C(C=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)OCC=C)C5=C(O2)C=CC(=C5)Br)OC
InChI=1SC27H25BrN2O4c141333209517(61020)221623211519(28)81224(21)3427(30(23)2922)1871125(312)26(1418)323h41214152327H11316H223H3
MFCD03284442
ZINC000009041186
ZINC000012193752
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