Vitas-M small molecule compound

7-benzyl-1,3-dimethyl-8-{[3-(morpholin-4-yl)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK262556
SMILES Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1ccccc1)NCCCN1CCOCC1

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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/c1-24-18-17(19(28)25(2)21(24)29)27(15-16-7-4-3-5-8-16)20(23-18)22-9-6-10-26-11-13-30-14-12-26/h3-5,7-8H,6,9-15H2,1-2H3,(H,22,23)
InChIKey
PXBZRXDDNNNYAG-UHFFFAOYSA-N
Synonyms

13DIMETHYL8((3MORPHOLIN4YLPROPYL)AMINO)7BENZYL137TRIHYDROPURINE26DIONE
7BENZYL13DIMETHYL8((3(4MORPHOLINYL)PROPYL)AMINO)37DIHYDRO1HPURINE26DIONE
7benzyl13dimethyl8((3(morpholin4yl)propyl)amino)37dihydro1Hpurine26dione
7BENZYL13DIMETHYL8(3MORPHOLIN4YLPROPYLAMINO)PURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCN3CCOCC3)CC4=CC=CC=C4
InChI=1SC21H28N6O3c1241817(19(28)25(2)21(24)29)27(15167435816)20(2318)22961026111330141226h3578H6915H212H3(H2223)
MFCD07621020
ZINC000019944084
ZINC19944084

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Available files

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