Vitas-M small molecule compound
8-bromo-7-[2-hydroxy-3-(naphthalen-1-yloxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK013266
SMILES OC(Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C)COc1cccc2c1cccc2
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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 C19H17BrN4O4 MW 445.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrN4O4/c1-23-16-15(17(26)22-19(23)27)24(18(20)21-16)9-12(25)10-28-14-8-4-6-11-5-2-3-7-13(11)14/h2-8,12,25H,9-10H2,1H3,(H,22,26,27)InChIKey
HVOOPCLOPXAESL-UHFFFAOYSA-NSynonyms
8BROMO7(2HYDROXY3(NAPHTHALEN1YLOXY)PROPYL)3METHYL37DIHYDRO1HPURINE26DIONE
8BROMO7(2HYDROXY3NAPHTHALEN1YLOXYPROPYL)3METHYLPURINE26DIONE
8BROMO7(2HYDROXY3NAPHTHYLOXYPROPYL)3METHYL137TRIHYDROPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CC(COC3=CC=CC4=CC=CC=C43)O
InChI=1SC19H17BrN4O4c1231615(17(26)2219(23)27)24(18(20)2116)912(25)10281484611523713(11)14h281225H910H21H3(H222627)
MFCD01079318
OC(Cn1c(Br)nc2c1c(=O)(nH)c(=O)n2C)COc1cccc2c1cccc2
STK013266
ZINC000000626343
ZINC000000829852
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