Vitas-M small molecule compound

1'-[7-(4-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]-1,4'-bipiperidine-4'-carboxamide

Catalog ID
STK262580
SMILES Clc1ccc(cc1)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCC(CC1)(C(=O)N)N1CCCCC1

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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 C25H32ClN7O3 MW 514.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32ClN7O3/c1-29-20-19(21(34)30(2)24(29)36)33(16-17-6-8-18(26)9-7-17)23(28-20)31-14-10-25(11-15-31,22(27)35)32-12-4-3-5-13-32/h6-9H,3-5,10-16H2,1-2H3,(H2,27,35)
InChIKey
SZMKUVWDBHMHKE-UHFFFAOYSA-N
Synonyms

1(7((4CHLOROPHENYL)METHYL)13DIMETHYL26DIOXO(137TRIHYDROPURIN8YL))4PIPERIDYLPIPERIDINE4CARBOXAMIDE
1(7((4chlorophenyl)methyl)13dimethyl26dioxopurin8yl)4piperidin1ylpiperidine4carboxamide
1(7(4chlorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)14bipiperidine4carboxamide
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCC(CC3)(C(=O)N)N4CCCCC4)CC5=CC=C(C=C5)Cl
InChI=1SC25H32ClN7O3c1292019(21(34)30(2)24(29)36)33(16176818(26)9717)23(2820)31141025(11153122(27)35)32124351332h69H351016H212H3(H22735)
MFCD07621023
ZINC000008775042
ZINC8775042

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Available files

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