Vitas-M small molecule compound

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

Catalog ID
STK920313
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCC1

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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 C28H29N5O3 MW 483.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O3/c1-17-29-26-24(28(34)33(17)19-8-4-5-9-19)25-27(31-21-11-7-6-10-20(21)30-25)32(26)15-14-18-12-13-22(35-2)23(16-18)36-3/h6-7,10-13,16,19H,4-5,8-9,14-15H2,1-3H3
InChIKey
DBDFRLXXJYVRQK-UHFFFAOYSA-N
Synonyms
836630-42-3
3cyclopentyl11(2(34dimethoxyphenyl)ethyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3cyclopentyl11(34dimethoxyphenethyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836630423
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CCC5=CC(=C(C=C5)OC)OC)C(=O)N1C6CCCC6
InChI=1SC28H29N5O3c117292624(28(34)33(17)19845919)2527(312111761020(21)3025)32(26)151418121322(352)23(1618)363h6710131619H45891415H213H3
MFCD03688694
ZINC000002251064
ZINC02251064
ZINC2251064

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Available files

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