Vitas-M small molecule compound
8-(butan-2-ylamino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK852948
SMILES CCC(Nc1nc2c(n1CC(COc1ccccc1)O)c(=O)n(c(=O)n2C)C)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 C20H27N5O4 MW 401.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O4/c1-5-13(2)21-19-22-17-16(18(27)24(4)20(28)23(17)3)25(19)11-14(26)12-29-15-9-7-6-8-10-15/h6-10,13-14,26H,5,11-12H2,1-4H3,(H,21,22)InChIKey
XDFUSHARKRUOMV-UHFFFAOYSA-NSynonyms
868146-62-78(butan2ylamino)7(2hydroxy3phenoxypropyl)13dimethyl37dihydro1Hpurine26dione
8(BUTAN2YLAMINO)7(2HYDROXY3PHENOXYPROPYL)13DIMETHYLPURINE26DIONE
8(secbutylamino)7(2hydroxy3phenoxypropyl)13dimethyl1Hpurine26(3H7H)dione
868146627
CCC(C)NC1=NC2=C(N1CC(COC3=CC=CC=C3)O)C(=O)N(C(=O)N2C)C
InChI=1SC20H27N5O4c1513(2)2119221716(18(27)24(4)20(28)23(17)3)25(19)1114(26)12291597681015h610131426H51112H214H3(H2122)
MFCD05699862
ZINC000002702016
ZINC000013483353
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