Vitas-M small molecule compound

3-[(E)-{2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-1-[2-(3-methoxyphenoxy)ethyl]-1H-indole

Catalog ID
STK090185
SMILES COc1cccc(c1)OCCn1cc(c2c1cccc2)/C=N/Nc1nc(nc(n1)N1CCCCC1)N1CCCCC1

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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 C31H38N8O2 MW 554.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N8O2/c1-40-25-11-10-12-26(21-25)41-20-19-39-23-24(27-13-4-5-14-28(27)39)22-32-36-29-33-30(37-15-6-2-7-16-37)35-31(34-29)38-17-8-3-9-18-38/h4-5,10-14,21-23H,2-3,6-9,15-20H2,1H3,(H,33,34,35,36)/b32-22+
InChIKey
OUJOHOWZZDIQMM-WEMUVCOSSA-N
Synonyms

1(2(3METHOXYPHENOXY)ETHYL)1HINDOLE3CARBALDEHYDE(46DIPIPERIDIN1YL135TRIAZIN2YL)HYDRAZONE
3((E)(2(46DI(PIPERIDIN1YL)135TRIAZIN2YL)HYDRAZINYLIDENE)METHYL)1(2(3METHOXYPHENOXY)ETHYL)1HINDOLE
COC1=CC(=CC=C1)OCCN2C=C(C3=CC=CC=C32)C=NNC4=NC(=NC(=N4)N5CCCCC5)N6CCCCC6
COc1cccc(c1)OCCn1cc(c2c1cccc2)C=NNc1nc(nc(n1)N1CCCCC1)N1CCCCC1
InChI=1SC31H38N8O2c1402511101226(2125)412019392324(2713451428(27)39)223236293330(37156271637)3531(3429)38178391838h4510142123H23691520H21H3(H33343536)b3222+
MFCD02950940
N((E)(1(2(3methoxyphenoxy)ethyl)indol3yl)methylideneamino)46di(piperidin1yl)135triazin2amine
STK090185
ZINC000008451380
ZINC101492379

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Available files

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