Vitas-M small molecule compound
methyl 3-({[4-(7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Catalog ID
STK527732
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)[nH]c(=O)n3C)cccc2
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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 C24H28N8O5 MW 508.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N8O5/c1-4-32-19-20(29(2)24(36)28-21(19)34)27-23(32)31-11-9-30(10-12-31)13-16(33)26-17-14-7-5-6-8-15(14)25-18(17)22(35)37-3/h5-8,25H,4,9-13H2,1-3H3,(H,26,33)(H,28,34,36)InChIKey
DQRVQOALFRQTRW-UHFFFAOYSA-NSynonyms
371942-33-5371942335
CCN1C2=C(N=C1N3CCN(CC3)CC(=O)NC4=C(NC5=CC=CC=C54)C(=O)OC)N(C(=O)NC2=O)C
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)(nH)c(=O)n3C)cccc2
InChI=1SC24H28N8O5c14321920(29(2)24(36)2821(19)34)2723(32)3111930(101231)1316(33)261714756815(14)2518(17)22(35)373h5825H4913H213H3(H2633)(H283436)
methyl3(((4(7ethyl3methyl26dioxo2367tetrahydro1Hpurin8yl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL3((2(4(7ETHYL3METHYL26DIOXOPURIN8YL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl3(2(4(7ethyl3methyl26dioxo2367tetrahydro1Hpurin8yl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD01562914
ZINC000057050735
ZINC57050735
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.