Vitas-M small molecule compound
7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834049
SMILES OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCC1)COc1ccc(cc1)Cl
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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 C20H24ClN5O4 MW 433.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN5O4/c1-24-17-16(18(28)23-20(24)29)26(19(22-17)25-9-3-2-4-10-25)11-14(27)12-30-15-7-5-13(21)6-8-15/h5-8,14,27H,2-4,9-12H2,1H3,(H,23,28,29)InChIKey
NGXFCLGZSLACPB-UHFFFAOYSA-NSynonyms
331675-15-1331675151
7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL8(PIPERIDIN1YL)1HPURINE26(3H7H)DIONE
7(3(4chlorophenoxy)2hydroxypropyl)3methyl8(piperidin1yl)37dihydro1Hpurine26dione
7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL8PIPERIDIN1YLPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CC(COC4=CC=C(C=C4)Cl)O
InChI=1SC20H24ClN5O4c1241716(18(28)2320(24)29)26(19(2217)2593241025)1114(27)1230157513(21)6815h581427H24912H21H3(H232829)
MFCD00754413
OC(Cn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCCCC1)COc1ccc(cc1)Cl
ZINC000000632451
ZINC000000632456
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