Vitas-M small molecule compound

8-{4-[(4-chlorophenyl)carbonyl]piperazin-1-yl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK262636
SMILES Clc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2c([nH]1)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 C18H19ClN6O3 MW 402.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN6O3/c1-22-14-13(16(27)23(2)18(22)28)20-17(21-14)25-9-7-24(8-10-25)15(26)11-3-5-12(19)6-4-11/h3-6H,7-10H2,1-2H3,(H,20,21)
InChIKey
FBSYRGBEDNFSLO-UHFFFAOYSA-N
Synonyms
885900-41-4
8(4((4chlorophenyl)carbonyl)piperazin1yl)13dimethyl37dihydro1Hpurine26dione
8(4((4CHLOROPHENYL)CARBONYL)PIPERAZINYL)13DIMETHYL137TRIHYDROPURINE26DIONE
8(4(4CHLOROBENZOYL)PIPERAZIN1YL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
8(4(4chlorobenzoyl)piperazin1yl)13dimethyl7Hpurine26dione
885900414
Clc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2c((nH)1)c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl
InChI=1SC18H19ClN6O3c1221413(16(27)23(2)18(22)28)2017(2114)259724(81025)15(26)113512(19)6411h36H710H212H3(H2021)
MFCD07037372
ZINC000004818401
ZINC04818401
ZINC4818401

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Available files

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