Vitas-M small molecule compound

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

Catalog ID
STK997331
SMILES NC(=O)C1CCN(CC1)c1nc2c(n1CCCc1ccccc1)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 C22H28N6O3 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N6O3/c1-25-19-17(20(30)26(2)22(25)31)28(12-6-9-15-7-4-3-5-8-15)21(24-19)27-13-10-16(11-14-27)18(23)29/h3-5,7-8,16H,6,9-14H2,1-2H3,(H2,23,29)
InChIKey
ISTLBGZWQXWQDT-UHFFFAOYSA-N
Synonyms
442864-67-7
1(13DIMETHYL26DIOXO7(3PHENYLPROPYL)137TRIHYDROPURIN8YL)PIPERIDINE4CARBOXAMIDE
1(13dimethyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)piperidine4carboxamide
1(13DIMETHYL26DIOXO7(3PHENYLPROPYL)PURIN8YL)PIPERIDINE4CARBOXAMIDE
442864677
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCC(CC3)C(=O)N)CCCC4=CC=CC=C4
InChI=1SC22H28N6O3c1251917(20(30)26(2)22(25)31)28(1269157435815)21(2419)27131016(111427)18(23)29h357816H6914H212H3(H22329)
MFCD03301430
ZINC000000631638
ZINC00631638
ZINC631638

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Available files

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