Vitas-M small molecule compound
7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-3-methyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840393
SMILES CCc1ccc(cc1)OCC(Cn1c(NCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)O
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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 C25H29N5O4 MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O4/c1-3-17-9-11-20(12-10-17)34-16-19(31)15-30-21-22(29(2)25(33)28-23(21)32)27-24(30)26-14-13-18-7-5-4-6-8-18/h4-12,19,31H,3,13-16H2,1-2H3,(H,26,27)(H,28,32,33)InChIKey
GRPRUPGRTIXUIA-UHFFFAOYSA-NSynonyms
7(3(4ethylphenoxy)2hydroxypropyl)3methyl8((2phenylethyl)amino)37dihydro1Hpurine26dione
7(3(4ethylphenoxy)2hydroxypropyl)3methyl8(2phenylethylamino)purine26dione
7(3(4ethylphenoxy)2hydroxypropyl)3methyl8(phenethylamino)1Hpurine26(3H7H)dione
7(3(4ETHYLPHENOXY)2HYDROXYPROPYL)3METHYL8(PHENETHYLAMINO)PURINE26DIONE
CCC1=CC=C(C=C1)OCC(CN2C3=C(N=C2NCCC4=CC=CC=C4)N(C(=O)NC3=O)C)O
CCc1ccc(cc1)OCC(Cn1c(NCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C)O
InChI=1SC25H29N5O4c131791120(121017)341619(31)15302122(29(2)25(33)2823(21)32)2724(30)261413187546818h4121931H31316H212H3(H2627)(H283233)
MFCD02231635
ZINC000000626077
ZINC000000626080
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