Vitas-M small molecule compound

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

Catalog ID
STK238121
SMILES COc1ccc(cc1)CNC(=O)CCn1cnc2c1c(=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 C18H21N5O4 MW 371.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O4/c1-21-16-15(17(25)22(2)18(21)26)23(11-20-16)9-8-14(24)19-10-12-4-6-13(27-3)7-5-12/h4-7,11H,8-10H2,1-3H3,(H,19,24)
InChIKey
BXADQPPNATUJQC-UHFFFAOYSA-N
Synonyms
887683-03-6
3(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))N((4METHOXYPHENYL)METHYL)PROPANAMIDE
3(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N(4methoxybenzyl)propanamide
3(13DIMETHYL26DIOXOPURIN7YL)N((4METHOXYPHENYL)METHYL)PROPANAMIDE
887683036
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)NCC3=CC=C(C=C3)OC
InChI=1SC18H21N5O4c1211615(17(25)22(2)18(21)26)23(112016)9814(24)1910124613(273)7512h4711H810H213H3(H1924)
MFCD07398027
ZINC000004943411
ZINC04943411
ZINC4943411

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Available files

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