Vitas-M small molecule compound
6-[2-(3,4-dichlorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
Catalog ID
STK539663
SMILES COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(c(c1)Cl)Cl
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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 C25H20Cl2N2O5 MW 499.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20Cl2N2O5/c1-32-21-10-8-15(22(25(30)31)23(21)33-2)24-29-19(14-5-3-4-6-20(14)34-24)12-18(28-29)13-7-9-16(26)17(27)11-13/h3-11,19,24H,12H2,1-2H3,(H,30,31)InChIKey
SNIMEQHMORWIBL-UHFFFAOYSA-NSynonyms
385421-40-9385421409
6(2(34dichlorophenyl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)23dimethoxybenzoicacid
6(2(34dichlorophenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)23dimethoxybenzoicacid
6(2(34DICHLOROPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)23DIMETHOXYBENZOICACID
COC1=C(C(=C(C=C1)C2N3C(CC(=N3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5O2)C(=O)O)OC
InChI=1SC25H20Cl2N2O5c1322110815(22(25(30)31)23(21)332)242919(14534620(14)3424)1218(2829)137916(26)17(27)1113h3111924H12H212H3(H3031)
MFCD03286198
ZINC000009216612
ZINC000013552685
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