Vitas-M small molecule compound

6-hydroxy-8-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STL054231
SMILES Oc1nc(=O)n(c2c1n(CCOc1ccccc1)c(n2)NCCCn1cncc1)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 C20H23N7O3 MW 409.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N7O3/c1-25-17-16(18(28)24-20(25)29)27(12-13-30-15-6-3-2-4-7-15)19(23-17)22-8-5-10-26-11-9-21-14-26/h2-4,6-7,9,11,14H,5,8,10,12-13H2,1H3,(H,22,23)(H,24,28,29)
InChIKey
AZYYVCWBPKIMLE-UHFFFAOYSA-N
Synonyms
476481-43-3
476481433
6hydroxy8((3(1Himidazol1yl)propyl)amino)3methyl7(2phenoxyethyl)37dihydro2Hpurin2one
8(3IMIDAZOL1YLPROPYLAMINO)3METHYL7(2PHENOXYETHYL)PURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCCN3C=CN=C3)CCOC4=CC=CC=C4
InChI=1SC20H23N7O3c1251716(18(28)2420(25)29)27(121330156324715)19(2317)22851026119211426h246791114H58101213H21H3(H2223)(H242829)
MFCD05727406
ZINC000001778990
ZINC1778990

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Available files

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