Vitas-M small molecule compound

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

Catalog ID
STK203458
SMILES Nc1nc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)nc(n1)Nc1ccc(c(c1)C)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 C24H29N7O2 MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N7O2/c1-16-3-5-19(11-17(16)2)26-24-28-22(27-23(25)29-24)14-31-9-7-30(8-10-31)13-18-4-6-20-21(12-18)33-15-32-20/h3-6,11-12H,7-10,13-15H2,1-2H3,(H3,25,26,27,28,29)
InChIKey
RDDBFBQVXQXYJB-UHFFFAOYSA-N
Synonyms

(4AMINO6((4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)METHYL)(135TRIAZIN2YL))(34DIMETHYLPHENYL)AMINE
6((4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)METHYL)2N(34DIMETHYLPHENYL)135TRIAZINE24DIAMINE
6((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)N(34dimethylphenyl)135triazine24diamine
6((4(BENZO(D)(13)DIOXOL5YLMETHYL)PIPERAZIN1YL)METHYL)N2(34DIMETHYLPHENYL)135TRIAZINE24DIAMINE
CC1=C(C=C(C=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C
InChI=1SC24H29N7O2c1163519(1117(16)2)26242822(2723(25)2924)14319730(81031)1318462021(1218)33153220h361112H7101315H212H3(H32526272829)
MFCD06243428
ZINC000019899228
ZINC19899228

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Available files

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