Vitas-M small molecule compound
1,3-dimethyl-7-(3-methylbenzyl)-8-{[2-(morpholin-4-yl)ethyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK262555
SMILES Cc1cccc(c1)Cn1c(NCCN2CCOCC2)nc2c1c(=O)n(c(=O)n2C)C
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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 C21H28N6O3 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O3/c1-15-5-4-6-16(13-15)14-27-17-18(24(2)21(29)25(3)19(17)28)23-20(27)22-7-8-26-9-11-30-12-10-26/h4-6,13H,7-12,14H2,1-3H3,(H,22,23)InChIKey
CUTMFOPXLQTZPJ-UHFFFAOYSA-NSynonyms
13DIMETHYL7((3METHYLPHENYL)METHYL)8((2MORPHOLIN4YLETHYL)AMINO)137TRIHYDROPURINE26DIONE
13DIMETHYL7((3METHYLPHENYL)METHYL)8(2MORPHOLIN4YLETHYLAMINO)PURINE26DIONE
13DIMETHYL7(3METHYLBENZYL)8((2(4MORPHOLINYL)ETHYL)AMINO)37DIHYDRO1HPURINE26DIONE
13dimethyl7(3methylbenzyl)8((2(morpholin4yl)ethyl)amino)37dihydro1Hpurine26dione
CC1=CC(=CC=C1)CN2C3=C(N=C2NCCN4CCOCC4)N(C(=O)N(C3=O)C)C
InChI=1SC21H28N6O3c11554616(1315)14271718(24(2)21(29)25(3)19(17)28)2320(27)22782691130121026h4613H71214H213H3(H2223)
MFCD07621019
ZINC000019944080
ZINC19944080
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