Vitas-M small molecule compound

6-hydroxy-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one

Catalog ID
STL049962
SMILES OC(Cn1c(N/N=C/c2cccnc2)nc2c1c(O)nc(=O)n2C)COc1ccccc1

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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 C21H21N7O4 MW 435.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N7O4/c1-27-18-17(19(30)25-21(27)31)28(12-15(29)13-32-16-7-3-2-4-8-16)20(24-18)26-23-11-14-6-5-9-22-10-14/h2-11,15,29H,12-13H2,1H3,(H,24,26)(H,25,30,31)/b23-11+
InChIKey
YAZPCXBIHDOQPO-FOKLQQMPSA-N
Synonyms
716333-09-4
6hydroxy7(2hydroxy3phenoxypropyl)3methyl8((2E)2(pyridin3ylmethylidene)hydrazinyl)37dihydro2Hpurin2one
7(2hydroxy3phenoxypropyl)3methyl8((2E)2(pyridin3ylmethylidene)hydrazinyl)purine26dione
716333094
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CN=CC=C3)CC(COC4=CC=CC=C4)O
InChI=1SC21H21N7O4c1271817(19(30)2521(27)31)28(1215(29)1332167324816)20(2418)26231114659221014h2111529H1213H21H3(H2426)(H253031)b2311+
MFCD05738181
OC(Cn1c(NN=Cc2cccnc2)nc2c1c(O)nc(=O)n2C)COc1ccccc1
ZINC000009158558
ZINC000009158560

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Available files

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