Vitas-M small molecule compound

7-(3-chlorobenzyl)-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK089254
SMILES Clc1cccc(c1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1

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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 C19H22ClN5O2 MW 387.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN5O2/c1-22-16-15(17(26)23(2)19(22)27)25(12-13-7-6-8-14(20)11-13)18(21-16)24-9-4-3-5-10-24/h6-8,11H,3-5,9-10,12H2,1-2H3
InChIKey
KEWBRJOMTXBJAL-UHFFFAOYSA-N
Synonyms

7((3CHLOROPHENYL)METHYL)13DIMETHYL8PIPERIDIN1YLPURINE26DIONE
7(3CHLOROBENZYL)13DIMETHYL8(PIPERIDIN1YL)37DIHYDRO1HPURINE26DIONE
7(3CHLOROBENZYL)13DIMETHYL8PIPERIDIN1YL37DIHYDROPURINE26DIONE
Clc1cccc(c1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC4=CC(=CC=C4)Cl
InChI=1SC19H22ClN5O2c1221615(17(26)23(2)19(22)27)25(121376814(20)1113)18(2116)2494351024h6811H3591012H212H3
MFCD01929542
STK089254
ZINC000000832607
ZINC00832607
ZINC832607

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Available files

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