Vitas-M small molecule compound

4-(2-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]-8-methyl-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one

Catalog ID
STK292136
SMILES COc1ccc(cc1)N1CCN(CC1)C1=NC(n2c(N1)nc(C)cc2=O)c1ccccc1OC

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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 C25H28N6O3 MW 460.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O3/c1-17-16-22(32)31-23(20-6-4-5-7-21(20)34-3)27-24(28-25(31)26-17)30-14-12-29(13-15-30)18-8-10-19(33-2)11-9-18/h4-11,16,23H,12-15H2,1-3H3,(H,26,27,28)
InChIKey
XAGGHNKYQRBHIF-UHFFFAOYSA-N
Synonyms
923221-09-4
4(2methoxyphenyl)2(4(4methoxyphenyl)piperazin1yl)8methyl14dihydro6Hpyrimido(12a)(135)triazin6one
4(2methoxyphenyl)2(4(4methoxyphenyl)piperazin1yl)8methyl49dihydropyrimido(12a)(135)triazin6one
923221094
CC1=CC(=O)N2C(N=C(N=C2N1)N3CCN(CC3)C4=CC=C(C=C4)OC)C5=CC=CC=C5OC
InChI=1SC25H28N6O3c1171622(32)3123(20645721(20)343)2724(2825(31)2617)30141229(131530)1881019(332)11918h4111623H1215H213H3(H262728)
MFCD08710272
ZINC000008990125

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Available files

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