Vitas-M small molecule compound

8-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL005991
SMILES Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1cccc2c1cccc2)NCCCn1cncc1

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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 C24H25N7O2 MW 443.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N7O2/c1-28-21-20(22(32)29(2)24(28)33)31(15-18-9-5-8-17-7-3-4-10-19(17)18)23(27-21)26-11-6-13-30-14-12-25-16-30/h3-5,7-10,12,14,16H,6,11,13,15H2,1-2H3,(H,26,27)
InChIKey
LVBFAMOACYSXAH-UHFFFAOYSA-N
Synonyms
476479-97-7
476479977
8((3(1HIMIDAZOL1YL)PROPYL)AMINO)13DIMETHYL7(NAPHTHALEN1YLMETHYL)1HPURINE26(3H7H)DIONE
8((3(1Himidazol1yl)propyl)amino)13dimethyl7(naphthalen1ylmethyl)37dihydro1Hpurine26dione
8((3IMIDAZOLYLPROPYL)AMINO)13DIMETHYL7(NAPHTHYLMETHYL)137TRIHYDROPURINE26DIONE
8(3IMIDAZOL1YLPROPYLAMINO)13DIMETHYL7(NAPHTHALEN1YLMETHYL)PURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCN3C=CN=C3)CC4=CC=CC5=CC=CC=C54
InChI=1SC24H25N7O2c1282120(22(32)29(2)24(28)33)31(1518958177341019(17)18)23(2721)2611613301412251630h35710121416H6111315H212H3(H2627)
MFCD03933537
ZINC000006444926
ZINC06444926
ZINC6444926

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Available files

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