Vitas-M small molecule compound
6-hydroxy-8-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-7-(1-phenylethyl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK558822
SMILES Oc1nc(=O)n(c2c1n(c(n2)NCCCn1cncc1)C(c1ccccc1)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 C20H23N7O2 MW 393.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N7O2/c1-14(15-7-4-3-5-8-15)27-16-17(25(2)20(29)24-18(16)28)23-19(27)22-9-6-11-26-12-10-21-13-26/h3-5,7-8,10,12-14H,6,9,11H2,1-2H3,(H,22,23)(H,24,28,29)InChIKey
NPHJBVJUEJJSBD-UHFFFAOYSA-NSynonyms
476480-28-16hydroxy8((3(1Himidazol1yl)propyl)amino)3methyl7(1phenylethyl)37dihydro2Hpurin2one
8(3IMIDAZOL1YLPROPYLAMINO)3METHYL7(1PHENYLETHYL)37DIHYDROPURINE26DIONE
8(3IMIDAZOL1YLPROPYLAMINO)3METHYL7(1PHENYLETHYL)PURINE26DIONE
CC(C1=CC=CC=C1)N2C3=C(N=C2NCCCN4C=CN=C4)N(C(=O)NC3=O)C
InChI=1SC20H23N7O2c114(157435815)271617(25(2)20(29)2418(16)28)2319(27)229611261210211326h3578101214H6911H212H3(H2223)(H242829)
MFCD04080899
ZINC000001862562
ZINC000001862565
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