Vitas-M small molecule compound
1-(4-chlorobenzyl)-3,7-dimethyl-8-{[3-(morpholin-4-yl)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL342048
SMILES Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NCCCN1CCOCC1
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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 C21H27ClN6O3 MW 446.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27ClN6O3/c1-25-17-18(24-20(25)23-8-3-9-27-10-12-31-13-11-27)26(2)21(30)28(19(17)29)14-15-4-6-16(22)7-5-15/h4-7H,3,8-14H2,1-2H3,(H,23,24)InChIKey
QYMSWYNUIKWNSX-UHFFFAOYSA-NSynonyms
586996-36-31((4CHLOROPHENYL)METHYL)37DIMETHYL8(3MORPHOLIN4YLPROPYLAMINO)PURINE26DIONE
1(4chlorobenzyl)37dimethyl8((3(morpholin4yl)propyl)amino)37dihydro1Hpurine26dione
1(4chlorobenzyl)37dimethyl8((3morpholinopropyl)amino)1Hpurine26(3H7H)dione
586996363
CN1C2=C(N=C1NCCCN3CCOCC3)N(C(=O)N(C2=O)CC4=CC=C(C=C4)Cl)C
InChI=1SC21H27ClN6O3c1251718(2420(25)2383927101231131127)26(2)21(30)28(19(17)29)14154616(22)7515h47H3814H212H3(H2324)
MFCD04032164
ZINC000020332080
ZINC20332080
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