Vitas-M small molecule compound
7-(2-chloro-5-methoxybenzyl)-8-{[3-(dimethylamino)propyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697712
SMILES COc1ccc(c(c1)Cn1c(NCCCN(C)C)nc2c1c(=O)n(c(=O)n2C)C)Cl
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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 C20H27ClN6O3 MW 434.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27ClN6O3/c1-24(2)10-6-9-22-19-23-17-16(18(28)26(4)20(29)25(17)3)27(19)12-13-11-14(30-5)7-8-15(13)21/h7-8,11H,6,9-10,12H2,1-5H3,(H,22,23)InChIKey
IDDWWADKKFJVFN-UHFFFAOYSA-NSynonyms
833439-02-47((2CHLORO5METHOXYPHENYL)METHYL)8(3(DIMETHYLAMINO)PROPYLAMINO)13DIMETHYLPURINE26DIONE
7(2chloro5methoxybenzyl)8((3(dimethylamino)propyl)amino)13dimethyl1Hpurine26(3H7H)dione
7(2chloro5methoxybenzyl)8((3(dimethylamino)propyl)amino)13dimethyl37dihydro1Hpurine26dione
833439024
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCN(C)C)CC3=C(C=CC(=C3)OC)Cl
InChI=1SC20H27ClN6O3c124(2)10692219231716(18(28)26(4)20(29)25(17)3)27(19)12131114(305)7815(13)21h7811H691012H215H3(H2223)
MFCD06607205
ZINC000002331886
ZINC2331886
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