Vitas-M small molecule compound

6-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-N-(3-chloro-4-methylphenyl)-1,3,5-triazine-2,4-diamine

Catalog ID
STK203323
SMILES Nc1nc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)nc(n1)Nc1ccc(c(c1)Cl)C

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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 C23H26ClN7O2 MW 467.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN7O2/c1-15-2-4-17(11-18(15)24)26-23-28-21(27-22(25)29-23)13-31-8-6-30(7-9-31)12-16-3-5-19-20(10-16)33-14-32-19/h2-5,10-11H,6-9,12-14H2,1H3,(H3,25,26,27,28,29)
InChIKey
GCAQITKQIFCUJH-UHFFFAOYSA-N
Synonyms
774591-57-0
(4AMINO6((4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)METHYL)(135TRIAZIN2YL))(3CHLORO4METHYLPHENYL)AMINE
6((4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)METHYL)2N(3CHLORO4METHYLPHENYL)135TRIAZINE24DIAMINE
6((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)N(3chloro4methylphenyl)135triazine24diamine
6((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methyl)N2(3chloro4methylphenyl)135triazine24diamine
774591570
CC1=C(C=C(C=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)Cl
InChI=1SC23H26ClN7O2c1152417(1118(15)24)26232821(2722(25)2923)13318630(7931)1216351920(1016)33143219h251011H691214H21H3(H32526272829)
MFCD06593040
ZINC22783695

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Available files

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