Vitas-M small molecule compound

2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-methoxyphenyl)butanamide

Catalog ID
STK344227
SMILES COc1ccccc1NC(=O)C(n1cnc2c1c(=O)n(C)c(=O)n2C)CC

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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 C18H21N5O4 MW 371.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O4/c1-5-12(16(24)20-11-8-6-7-9-13(11)27-4)23-10-19-15-14(23)17(25)22(3)18(26)21(15)2/h6-10,12H,5H2,1-4H3,(H,20,24)
InChIKey
DIFGNCOIHSBGNN-UHFFFAOYSA-N
Synonyms
847853-18-3
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N(2methoxyphenyl)butanamide
2(13dimethyl26dioxopurin7yl)N(2methoxyphenyl)butanamide
847853183
CCC(C(=O)NC1=CC=CC=C1OC)N2C=NC3=C2C(=O)N(C(=O)N3C)C
InChI=1SC18H21N5O4c1512(16(24)2011867913(11)274)2310191514(23)17(25)22(3)18(26)21(15)2h61012H5H214H3(H2024)
MFCD07130172
ZINC000009975064
ZINC000009975065

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Available files

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