Vitas-M small molecule compound

8-(azepan-1-yl)-6-hydroxy-3-methyl-7-(propan-2-yl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STK594094
SMILES Oc1nc(=O)n(c2c1n(C(C)C)c(n2)N1CCCCCC1)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 C15H23N5O2 MW 305.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H23N5O2/c1-10(2)20-11-12(18(3)15(22)17-13(11)21)16-14(20)19-8-6-4-5-7-9-19/h10H,4-9H2,1-3H3,(H,17,21,22)
InChIKey
ORXBYZBVGAHFTQ-UHFFFAOYSA-N
Synonyms
300732-88-1
300732881
8(AZEPAN1YL)3METHYL7PROPAN2YLPURINE26DIONE
8(azepan1yl)6hydroxy3methyl7(propan2yl)37dihydro2Hpurin2one
8(AZEPAN1YL)7ISOPROPYL3METHYL1HPURINE26(3H7H)DIONE
8AZAPERHYDROEPINYL3METHYL7(METHYLETHYL)137TRIHYDROPURINE26DIONE
8AZEPAN1YL7ISOPROPYL3METHYL37DIHYDROPURINE26DIONE
CC(C)N1C2=C(N=C1N3CCCCCC3)N(C(=O)NC2=O)C
InChI=1SC15H23N5O2c110(2)201112(18(3)15(22)1713(11)21)1614(20)1986457919h10H49H213H3(H172122)
MFCD07207499
ZINC000000265516
ZINC00265516
ZINC265516

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Available files

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