Vitas-M small molecule compound

2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(2,5-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK534220
SMILES COc1ccc(c(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc2c(c1)OCO2)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 C27H23N5O5 MW 497.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O5/c1-34-16-8-10-20(35-2)19(12-16)32-25(28)23(24-26(32)31-18-6-4-3-5-17(18)30-24)27(33)29-13-15-7-9-21-22(11-15)37-14-36-21/h3-12H,13-14,28H2,1-2H3,(H,29,33)
InChIKey
NHCOEMGYLIPTOK-UHFFFAOYSA-N
Synonyms
378200-03-4
2aminoN(13benzodioxol5ylmethyl)1(25dimethoxyphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINON(13BENZODIOXOL5YLMETHYL)1(25DIMETHOXYPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2AMINON(2H13BENZODIOXOL5YLMETHYL)1(25DIMETHOXYPHENYL)1HPYRROLO(23B)QUINOXALINE3CARBOXAMIDE
2aminoN(benzo(d)(13)dioxol5ylmethyl)1(25dimethoxyphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
378200034
COC1=CC(=C(C=C1)OC)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N
InChI=1SC27H23N5O5c1341681020(352)19(1216)3225(28)23(2426(32)3118643517(18)3024)27(33)291315792122(1115)37143621h312H131428H212H3(H2933)
MFCD02163720
ZINC000002291305
ZINC02291305
ZINC2291305

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Available files

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