Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Catalog ID
STK874995
SMILES COc1ccc(cc1)n1cc(c2c1ncnc2NCc1ccc2c(c1)OCO2)c1ccccc1
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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 C27H22N4O3 MW 450.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O3/c1-32-21-10-8-20(9-11-21)31-15-22(19-5-3-2-4-6-19)25-26(29-16-30-27(25)31)28-14-18-7-12-23-24(13-18)34-17-33-23/h2-13,15-16H,14,17H2,1H3,(H,28,29,30)InChIKey
NYEAFMCLKVXNHR-UHFFFAOYSA-NSynonyms
(2HBENZO(34D)13DIOXOLAN5YLMETHYL)(7(4METHOXYPHENYL)5PHENYLPYRROLO(32E)PYRIMIDIN4YL)AMINE
COC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NCC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6
InChI=1SC27H22N4O3c1322110820(91121)311522(195324619)2526(29163027(25)31)2814187122324(1318)34173323h2131516H1417H21H3(H282930)
MFCD04216774
N(13benzodioxol5ylmethyl)7(4methoxyphenyl)5phenyl7Hpyrrolo(23d)pyrimidin4amine
N(13BENZODIOXOL5YLMETHYL)7(4METHOXYPHENYL)5PHENYLPYRROLO(23D)PYRIMIDIN4AMINE
ZINC000001108564
ZINC01108564
ZINC1108564
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