Vitas-M small molecule compound

7-(2,6-dichlorobenzyl)-8-[(4-hydroxybutyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL296059
SMILES OCCCCNc1nc2c(n1Cc1c(Cl)cccc1Cl)c(=O)n(c(=O)n2C)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 C18H21Cl2N5O3 MW 426.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21Cl2N5O3/c1-23-15-14(16(27)24(2)18(23)28)25(17(22-15)21-8-3-4-9-26)10-11-12(19)6-5-7-13(11)20/h5-7,26H,3-4,8-10H2,1-2H3,(H,21,22)
InChIKey
FTFBKLZHTKDYHY-UHFFFAOYSA-N
Synonyms
359909-37-8
359909378
7((26DICHLOROPHENYL)METHYL)8(4HYDROXYBUTYLAMINO)13DIMETHYLPURINE26DIONE
7(26dichlorobenzyl)8((4hydroxybutyl)amino)13dimethyl1Hpurine26(3H7H)dione
7(26dichlorobenzyl)8((4hydroxybutyl)amino)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCCO)CC3=C(C=CC=C3Cl)Cl
InChI=1SC18H21Cl2N5O3c1231514(16(27)24(2)18(23)28)25(17(2215)21834926)101112(19)65713(11)20h5726H34810H212H3(H2122)
MFCD00837031
ZINC000008926352
ZINC08926352
ZINC8926352

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Available files

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