Vitas-M small molecule compound

8-{[2-(dimethylamino)ethyl]amino}-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK557127
SMILES CN(CCNc1nc2c(n1CC(COc1ccccc1C)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/c1-14-8-6-7-9-16(14)31-13-15(28)12-27-17-18(23-20(27)22-10-11-24(2)3)25(4)21(30)26(5)19(17)29/h6-9,15,28H,10-13H2,1-5H3,(H,22,23)
InChIKey
HDTFOVNDAVOWAY-UHFFFAOYSA-N
Synonyms
510717-21-2
510717212
8((2(DIMETHYLAMINO)ETHYL)AMINO)7(2HYDROXY3(2METHYLPHENOXY)PROPYL)13DIMETHYL137TRIHYDROPURINE26DIONE
8((2(dimethylamino)ethyl)amino)7(2hydroxy3(2methylphenoxy)propyl)13dimethyl37dihydro1Hpurine26dione
8((2(DIMETHYLAMINO)ETHYL)AMINO)7(2HYDROXY3(OTOLYLOXY)PROPYL)13DIMETHYL1HPURINE26(3H7H)DIONE
8(2(DIMETHYLAMINO)ETHYLAMINO)13DIMETHYL7(3(2METHYLPHENOXY)2OXIDANYLPROPYL)PURINE26DIONE
8(2(DIMETHYLAMINO)ETHYLAMINO)7(2HYDROXY3(2METHYLPHENOXY)PROPYL)13DIMETHYLPURINE26DIONE
8(2(DIMETHYLAMINO)ETHYLAMINO)7(2HYDROXY3(2METHYLPHENOXY)PROPYL)13DIMETHYLXANTHINE
8(2DIMETHYLAMINOETHYLAMINO)7(2HYDROXY3(2METHYLPHENOXY)PROPYL)13DIMETHYLPURINE26DIONE
CC1=CC=CC=C1OCC(CN2C3=C(N=C2NCCN(C)C)N(C(=O)N(C3=O)C)C)O
InChI=1SC21H30N6O4c114867916(14)311315(28)12271718(2320(27)22101124(2)3)25(4)21(30)26(5)19(17)29h691528H1013H215H3(H2223)
MFCD03417458
ZINC000005356501
ZINC000005356506

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Available files

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