Vitas-M small molecule compound
2-(2-methoxy-5-{(E)-[(2-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)imino]methyl}benzyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK543219
SMILES COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
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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 C28H21N5O4 MW 491.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N5O4/c1-16-30-24-21-9-5-6-10-22(21)31-25(24)28(36)33(16)29-14-17-11-12-23(37-2)18(13-17)15-32-26(34)19-7-3-4-8-20(19)27(32)35/h3-14,31H,15H2,1-2H3/b29-14+InChIKey
AFYBDRWXYNZRAN-IPPBACCNSA-NSynonyms
500274-57-7(E)2(2methoxy5(((2methyl4oxo45dihydro3Hpyrimido(54b)indol3yl)imino)methyl)benzyl)isoindoline13dione
2((2METHOXY5((E)(2METHYL4OXO5HPYRIMIDO(54B)INDOL3YL)IMINOMETHYL)PHENYL)METHYL)ISOINDOLE13DIONE
2(2methoxy5((E)((2methyl4oxo45dihydro3Hpyrimido(54b)indol3yl)imino)methyl)benzyl)1Hisoindole13(2H)dione
500274577
CC1=NC2=C(C(=O)N1N=CC3=CC(=C(C=C3)OC)CN4C(=O)C5=CC=CC=C5C4=O)NC6=CC=CC=C62
COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)C=Nn1c(C)nc2c(c1=O)(nH)c1c2cccc1
InChI=1SC28H21N5O4c1163024219561022(21)3125(24)28(36)33(16)291417111223(372)18(1317)153226(34)19734820(19)27(32)35h31431H15H212H3b2914+
MFCD03303083
ZINC000009331856
ZINC33362489
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.