Vitas-M small molecule compound
8-{[2-(dimethylamino)ethyl]amino}-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK600250
SMILES CN(CCNc1nc2c(n1CC(COc1cccc(c1)C)O)c(=O)n(c(=O)n2C)C)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 C21H30N6O4 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N6O4/c1-14-7-6-8-16(11-14)31-13-15(28)12-27-17-18(23-20(27)22-9-10-24(2)3)25(4)21(30)26(5)19(17)29/h6-8,11,15,28H,9-10,12-13H2,1-5H3,(H,22,23)InChIKey
UMFDOIUIDIEDBD-UHFFFAOYSA-NSynonyms
868146-73-08((2(dimethylamino)ethyl)amino)7(2hydroxy3(3methylphenoxy)propyl)13dimethyl37dihydro1Hpurine26dione
8((2(DIMETHYLAMINO)ETHYL)AMINO)7(2HYDROXY3(MTOLYLOXY)PROPYL)13DIMETHYL1HPURINE26(3H7H)DIONE
8(2(dimethylamino)ethylamino)7(2hydroxy3(3methylphenoxy)propyl)13dimethylpurine26dione
8(2DIMETHYLAMINOETHYLAMINO)7(2HYDROXY3(3METHYLPHENOXY)PROPYL)13DIMETHYLPURINE26DIONE
868146730
CC1=CC(=CC=C1)OCC(CN2C3=C(N=C2NCCN(C)C)N(C(=O)N(C3=O)C)C)O
InChI=1SC21H30N6O4c11476816(1114)311315(28)12271718(2320(27)2291024(2)3)25(4)21(30)26(5)19(17)29h68111528H9101213H215H3(H2223)
MFCD05701325
ZINC000009292724
ZINC000009292725
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