Vitas-M small molecule compound

1,3-dimethyl-8-(4-methylpiperidin-1-yl)-7-(4-nitrobenzyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL295999
SMILES CC1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)[N+](=O)[O-])c(=O)n(c(=O)n2C)C

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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 C20H24N6O4 MW 412.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O4/c1-13-8-10-24(11-9-13)19-21-17-16(18(27)23(3)20(28)22(17)2)25(19)12-14-4-6-15(7-5-14)26(29)30/h4-7,13H,8-12H2,1-3H3
InChIKey
COJROSKWYDTYSU-UHFFFAOYSA-N
Synonyms
667881-12-1
13DIMETHYL8(4METHYLPIPERIDIN1YL)7((4NITROPHENYL)METHYL)PURINE26DIONE
13dimethyl8(4methylpiperidin1yl)7(4nitrobenzyl)1Hpurine26(3H7H)dione
13dimethyl8(4methylpiperidin1yl)7(4nitrobenzyl)37dihydro1Hpurine26dione
667881121
7(4NITROBENZYL)13DIMETHYL8(4METHYL1PIPERIDINYL)37DIHYDRO1HPURINE26DIONE
CC1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)(N+)(=O)(O))c(=O)n(c(=O)n2C)C
CC1CCN(CC1)C2=NC3=C(N2CC4=CC=C(C=C4)(N+)(=O)(O))C(=O)N(C(=O)N3C)C
InChI=1SC20H24N6O4c11381024(11913)19211716(18(27)23(3)20(28)22(17)2)25(19)12144615(7514)26(29)30h4713H812H213H3
MFCD04017850
ZINC000000640993
ZINC00640993
ZINC640993

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Available files

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