Vitas-M small molecule compound

3-hexyl-11-[2-(4-methoxyphenyl)ethyl]-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK990645
SMILES CCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2CCc1ccc(cc1)OC

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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 C28H31N5O2 MW 469.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2/c1-4-5-6-9-17-32-19(2)29-26-24(28(32)34)25-27(31-23-11-8-7-10-22(23)30-25)33(26)18-16-20-12-14-21(35-3)15-13-20/h7-8,10-15H,4-6,9,16-18H2,1-3H3
InChIKey
LDOORZRAHAIXIW-UHFFFAOYSA-N
Synonyms
844458-66-8
3hexyl11(2(4methoxyphenyl)ethyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3hexyl11(4methoxyphenethyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
844458668
CCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CCC5=CC=C(C=C5)OC)C
InChI=1SC28H31N5O2c14569173219(2)292624(28(32)34)2527(312311871022(23)3025)33(26)181620121421(353)151320h781015H4691618H213H3
MFCD04156235
ZINC000002401444
ZINC02401444
ZINC2401444

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Available files

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