Vitas-M small molecule compound
8-bromo-7-{3-[(5-chloro-2-methoxyphenyl)amino]propyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK940892
SMILES COc1ccc(cc1NCCCn1c(Br)nc2c1c(O)nc(=O)n2C)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 C16H17BrClN5O3 MW 442.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrClN5O3/c1-22-13-12(14(24)21-16(22)25)23(15(17)20-13)7-3-6-19-10-8-9(18)4-5-11(10)26-2/h4-5,8,19H,3,6-7H2,1-2H3,(H,21,24,25)InChIKey
YIPPCMMICNMCBM-UHFFFAOYSA-NSynonyms
927542-68-58BROMO7(3((5CHLORO2METHOXYPHENYL)AMINO)PROPYL)3METHYL137TRIHYDROPURINE26DIONE
8bromo7(3((5chloro2methoxyphenyl)amino)propyl)6hydroxy3methyl37dihydro2Hpurin2one
8bromo7(3(5chloro2methoxyanilino)propyl)3methylpurine26dione
927542685
CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCCNC3=C(C=CC(=C3)Cl)OC
InChI=1SC16H17BrClN5O3c1221312(14(24)2116(22)25)23(15(17)2013)736191089(18)4511(10)262h45819H367H212H3(H212425)
MFCD18179653
ZINC000008762736
ZINC08762736
ZINC8762736
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