Vitas-M small molecule compound
8-(azepan-1-yl)-6-hydroxy-3-methyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STL044851
SMILES Oc1nc(=O)n(c2c1n(Cc1cccc3c1cccc3)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 C23H25N5O2 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O2/c1-26-20-19(21(29)25-23(26)30)28(22(24-20)27-13-6-2-3-7-14-27)15-17-11-8-10-16-9-4-5-12-18(16)17/h4-5,8-12H,2-3,6-7,13-15H2,1H3,(H,25,29,30)InChIKey
CESMWOZTTPHJPX-UHFFFAOYSA-NSynonyms
476480-09-8476480098
8(AZEPAN1YL)3METHYL7(NAPHTHALEN1YLMETHYL)1HPURINE26(3H7H)DIONE
8(AZEPAN1YL)3METHYL7(NAPHTHALEN1YLMETHYL)PURINE26DIONE
8(azepan1yl)6hydroxy3methyl7(naphthalen1ylmethyl)37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCCC3)CC4=CC=CC5=CC=CC=C54
InChI=1SC23H25N5O2c1262019(21(29)2523(26)30)28(22(2420)271362371427)151711810169451218(16)17h45812H23671315H21H3(H252930)
MFCD04080929
ZINC000004039293
ZINC04039293
ZINC4039293
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