Vitas-M small molecule compound

ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-[2-(4,6-diphenylpyrimidin-2-yl)hydrazinyl]pyrimidine-5-carboxylate

Catalog ID
STL240648
SMILES CCOC(=O)c1cnc(nc1NNc1nc(cc(n1)c1ccccc1)c1ccccc1)n1nc(cc1C)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 C28H26N8O2 MW 506.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N8O2/c1-4-38-26(37)22-17-29-28(36-19(3)15-18(2)35-36)32-25(22)33-34-27-30-23(20-11-7-5-8-12-20)16-24(31-27)21-13-9-6-10-14-21/h5-17H,4H2,1-3H3,(H,29,32,33)(H,30,31,34)
InChIKey
WUCCCZUFGIJIOJ-UHFFFAOYSA-N
Synonyms
958944-33-7
2(35DIMETHYLPYRAZOL1YL)4(N(46DIPHENYLPYRIMIDIN2YL)HYDRAZINO)PYRIMIDINE5CARBOXYLICACIDETHYLESTER
958944337
CCOC(=O)C1=CN=C(N=C1NNC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)N5C(=CC(=N5)C)C
ETHYL2(35DIMETHYL1HPYRAZOL1YL)4(2(46DIPHENYLPYRIMIDIN2YL)HYDRAZINO)PYRIMIDINE5CARBOXYLATE
ethyl2(35dimethyl1Hpyrazol1yl)4(2(46diphenylpyrimidin2yl)hydrazinyl)pyrimidine5carboxylate
ETHYL2(35DIMETHYLPYRAZOL1YL)4(2(46DIPHENYLPYRIMIDIN2YL)HYDRAZINYL)PYRIMIDINE5CARBOXYLATE
InChI=1SC28H26N8O2c143826(37)22172928(3619(3)1518(2)3536)3225(22)3334273023(20117581220)1624(3127)211396101421h517H4H213H3(H293233)(H303134)
MFCD04017360
ZINC000008682602
ZINC08682602
ZINC8682602

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.