Vitas-M small molecule compound

7-(1,3-benzodioxol-5-yl)-8-(2-chlorobenzyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione

Catalog ID
STL005269
SMILES Clc1ccccc1Cn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc2c(c1)OCO2

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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 C23H18ClN5O4 MW 463.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN5O4/c1-26-20-19(21(30)27(2)23(26)31)29-11-16(13-7-8-17-18(9-13)33-12-32-17)28(22(29)25-20)10-14-5-3-4-6-15(14)24/h3-9,11H,10,12H2,1-2H3
InChIKey
JRNMVRKKEHGTRS-UHFFFAOYSA-N
Synonyms
848923-97-7
7(13BENZODIOXOL5YL)6((2CHLOROPHENYL)METHYL)24DIMETHYLPURINO(78A)IMIDAZOLE13DIONE
7(13benzodioxol5yl)8(2chlorobenzyl)13dimethyl1Himidazo(21f)purine24(3H8H)dione
7(benzo(d)(13)dioxol5yl)8(2chlorobenzyl)13dimethyl1Himidazo(21f)purine24(3H8H)dione
848923977
CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4=CC=CC=C4Cl)C5=CC6=C(C=C5)OCO6
InChI=1SC23H18ClN5O4c1262019(21(30)27(2)23(26)31)291116(13781718(913)33123217)28(22(29)2520)1014534615(14)24h3911H1012H212H3
MFCD05677753
ZINC000009210826
ZINC09210826
ZINC9210826

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Available files

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