Vitas-M small molecule compound

2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-methylbenzyl)acetamide

Catalog ID
STK040127
SMILES Cc1ccc(cc1)CNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

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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 C17H19N5O3 MW 341.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O3/c1-11-4-6-12(7-5-11)8-18-13(23)9-22-10-19-15-14(22)16(24)21(3)17(25)20(15)2/h4-7,10H,8-9H2,1-3H3,(H,18,23)
InChIKey
ZQYUBEAVHBKVJN-UHFFFAOYSA-N
Synonyms
332117-69-8
2(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))N((4METHYLPHENYL)METHYL)ACETAMIDE
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N(4methylbenzyl)acetamide
2(13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)N(4methylbenzyl)acetamide
2(13DIMETHYL26DIOXOPURIN7YL)N((4METHYLPHENYL)METHYL)ACETAMIDE
332117698
CC1=CC=C(C=C1)CNC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C
Cc1ccc(cc1)CNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C
InChI=1SC17H19N5O3c1114612(7511)81813(23)92210191514(22)16(24)21(3)17(25)20(15)2h4710H89H213H3(H1823)
MFCD01993491
STK040127
ZINC000000263698
ZINC00263698
ZINC263698

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.