Vitas-M small molecule compound
5-(4-butoxyphenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL112522
SMILES CCCCOc1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1ccc2c(c1)OCCO2
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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 C28H28N2O4 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4/c1-2-3-14-31-21-11-8-19(9-12-21)28-30-24(22-6-4-5-7-25(22)34-28)18-23(29-30)20-10-13-26-27(17-20)33-16-15-32-26/h4-13,17,24,28H,2-3,14-16,18H2,1H3InChIKey
FNMTXUAFPUMEGQ-UHFFFAOYSA-NSynonyms
380351-02-0380351020
5(4butoxyphenyl)2(23dihydro14benzodioxin6yl)110bdihydropyrazolo(15c)(13)benzoxazine
5(4BUTOXYPHENYL)2(23DIHYDRO14BENZODIOXIN6YL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6O2
InChI=1SC28H28N2O4c12314312111819(91221)283024(22645725(22)3428)1823(2930)2010132627(1720)3316153226h413172428H23141618H21H3
MFCD03150505
ZINC000012555104
ZINC000012555110
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