Vitas-M small molecule compound

2-[(E)-2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(2-methoxyphenyl)quinazolin-4(3H)-one

Catalog ID
STK092963
SMILES COc1ccccc1n1c(/C=C/c2c(C)n(c3c2cccc3)C)nc2c(c1=O)cccc2

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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 C27H23N3O2 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O2/c1-18-19(20-10-5-7-13-23(20)29(18)2)16-17-26-28-22-12-6-4-11-21(22)27(31)30(26)24-14-8-9-15-25(24)32-3/h4-17H,1-3H3/b17-16+
InChIKey
NCTOKBKKTAGIFM-WUKNDPDISA-N
Synonyms
5806-79-1
(E)2(2(12dimethyl1Hindol3yl)vinyl)3(2methoxyphenyl)quinazolin4(3H)one
2((1E)2(12DIMETHYLINDOL3YL)VINYL)3(2METHOXYPHENYL)3HYDROQUINAZOLIN4ONE
2((E)2(12DIMETHYL1HINDOL3YL)ETHENYL)3(2METHOXYPHENYL)QUINAZOLIN4(3H)ONE
2((E)2(12DIMETHYLINDOL3YL)ETHENYL)3(2METHOXYPHENYL)QUINAZOLIN4ONE
5806791
CC1=C(C2=CC=CC=C2N1C)C=CC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC
COc1ccccc1n1c(C=Cc2c(C)n(c3c2cccc3)C)nc2c(c1=O)cccc2
InChI=1SC27H23N3O2c11819(2010571323(20)29(18)2)161726282212641121(22)27(31)30(26)2414891525(24)323h417H13H3b1716+
MFCD01559046
STK092963
ZINC000004785183
ZINC04785183
ZINC4785183

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Available files

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