Vitas-M small molecule compound
(5-methoxy-1,2-dimethyl-1H-indol-3-yl)[4-(7H-purin-6-yl)piperazin-1-yl]methanone
Catalog ID
STK642094
SMILES COc1ccc2c(c1)c(C(=O)N1CCN(CC1)c1ncnc3c1[nH]cn3)c(n2C)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 C21H23N7O2 MW 405.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N7O2/c1-13-17(15-10-14(30-3)4-5-16(15)26(13)2)21(29)28-8-6-27(7-9-28)20-18-19(23-11-22-18)24-12-25-20/h4-5,10-12H,6-9H2,1-3H3,(H,22,23,24,25)InChIKey
ZSPCEADWLASSSQ-UHFFFAOYSA-NSynonyms
1010898-33-5(4(9Hpurin6yl)piperazin1yl)(5methoxy12dimethyl1Hindol3yl)methanone
(5methoxy12dimethyl1Hindol3yl)(4(7Hpurin6yl)piperazin1yl)methanone
(5methoxy12dimethylindol3yl)(4(7Hpurin6yl)piperazin1yl)methanone
1010898335
CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)N3CCN(CC3)C4=NC=NC5=C4NC=N5
COc1ccc2c(c1)c(C(=O)N1CCN(CC1)c1ncnc3c1(nH)cn3)c(n2C)C
COc1ccc2c(c1)c(C(=O)N1CCN(CC1)c1ncnc3c1nc(nH)3)c(n2C)C
InChI=1SC21H23N7O2c11317(151014(303)4516(15)26(13)2)21(29)288627(7928)201819(23112218)24122520h451012H69H213H3(H22232425)
MFCD18162864
ZINC000012323607
ZINC12323607
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