Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-amine
Catalog ID
STL041545
SMILES c1ccc(cc1)c1nc(NCc2ccc3c(c2)OCO3)c2c(n1)c1ccccc1o2
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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 C24H17N3O3 MW 395.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17N3O3/c1-2-6-16(7-3-1)23-26-21-17-8-4-5-9-18(17)30-22(21)24(27-23)25-13-15-10-11-19-20(12-15)29-14-28-19/h1-12H,13-14H2,(H,25,26,27)InChIKey
KOQKRGATVGNOPH-UHFFFAOYSA-NSynonyms
c1ccc(cc1)c1nc(NCc2ccc3c(c2)OCO3)c2c(n1)c1ccccc1o2Cl
C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC4=C3OC5=CC=CC=C54)C6=CC=CC=C6
InChI=1SC24H17N3O3c12616(731)23262117845918(17)3022(21)24(2723)25131510111920(1215)29142819h112H1314H2(H252627)
MFCD04197197
N(13benzodioxol5ylmethyl)2phenyl(1)benzofuro(32d)pyrimidin4amine
N(benzo(d)(13)dioxol5ylmethyl)2phenylbenzofuro(32d)pyrimidin4aminehydrochloride
ZINC000005277788
ZINC05277788
ZINC5277788
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