Vitas-M small molecule compound
1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3'-methyl-1'-(7H-purin-6-yl)-1',7'-dihydrospiro[indole-3,4'-pyrazolo[3,4-b]pyridine]-2,6'(1H,5'H)-dione
Catalog ID
STL493862
SMILES O=C1Nc2n(nc(c2C2(C1)c1ccccc1N(C2=O)CCc1ccc2c(c1)CCO2)C)c1ncnc2c1[nH]cn2
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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 C29H24N8O3 MW 532.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N8O3/c1-16-23-26(37(35-16)27-24-25(31-14-30-24)32-15-33-27)34-22(38)13-29(23)19-4-2-3-5-20(19)36(28(29)39)10-8-17-6-7-21-18(12-17)9-11-40-21/h2-7,12,14-15H,8-11,13H2,1H3,(H,34,38)(H,30,31,32,33)InChIKey
XJQLKLFABOHQRZ-UHFFFAOYSA-NSynonyms
1(2(23dihydro1benzofuran5yl)ethyl)3methyl1(7Hpurin6yl)17dihydrospiro(indole34pyrazolo(34b)pyridine)26(1H5H)dione
1(2(23dihydrobenzofuran5yl)ethyl)3methyl1(9Hpurin6yl)57dihydrospiro(indoline34pyrazolo(34b)pyridine)26(1H)dione
MFCD30716040
O=C1Nc2n(nc(c2C2(C1)c1ccccc1N(C2=O)CCc1ccc2c(c1)CCO2)C)c1ncnc2c1(nH)cn2
O=C1Nc2n(nc(c2C2(C1)c1ccccc1N(C2=O)CCc1ccc2c(c1)CCO2)C)c1ncnc2c1nc(nH)2
ZINC000101409985
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