Vitas-M small molecule compound

8-(benzylamino)-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK840635
SMILES OC(Cn1c(NCc2ccccc2)nc2c1c(=O)n(C)c(=O)n2C)COc1ccccc1C

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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 C24H27N5O4 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O4/c1-16-9-7-8-12-19(16)33-15-18(30)14-29-20-21(27(2)24(32)28(3)22(20)31)26-23(29)25-13-17-10-5-4-6-11-17/h4-12,18,30H,13-15H2,1-3H3,(H,25,26)
InChIKey
LKDAIIBQGRVJMS-UHFFFAOYSA-N
Synonyms
333305-38-7
333305387
8(benzylamino)7(2hydroxy3(2methylphenoxy)propyl)13dimethyl37dihydro1Hpurine26dione
8(BENZYLAMINO)7(2HYDROXY3(2METHYLPHENOXY)PROPYL)13DIMETHYLPURINE26DIONE
8(BENZYLAMINO)7(2HYDROXY3(OTOLYLOXY)PROPYL)13DIMETHYL1HPURINE26(3H7H)DIONE
CC1=CC=CC=C1OCC(CN2C3=C(N=C2NCC4=CC=CC=C4)N(C(=O)N(C3=O)C)C)O
InChI=1SC24H27N5O4c1169781219(16)331518(30)14292021(27(2)24(32)28(3)22(20)31)2623(29)251317105461117h4121830H1315H213H3(H2526)
MFCD02227280
ZINC000000625757
ZINC000000625761

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Available files

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