Vitas-M small molecule compound

1-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-4-(pyrimidin-2-ylamino)butan-1-one

Catalog ID
STL567086
SMILES O=C(N1CCN(CC1)C(=O)C1COc2c(O1)cccc2)CCCNc1ncccn1

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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 C21H25N5O4 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O4/c27-19(7-3-8-22-21-23-9-4-10-24-21)25-11-13-26(14-12-25)20(28)18-15-29-16-5-1-2-6-17(16)30-18/h1-2,4-6,9-10,18H,3,7-8,11-15H2,(H,22,23,24)
InChIKey
JYISTPRINSTXOJ-UHFFFAOYSA-N
Synonyms
1630831-06-9
1(4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)4(pyrimidin2ylamino)butan1one
1(4(23dihydro14benzodioxine3carbonyl)piperazin1yl)4(pyrimidin2ylamino)butan1one
1(4(23DIHYDROBENZO(B)(14)DIOXINE2CARBONYL)PIPERAZIN1YL)4(PYRIMIDIN2YLAMINO)BUTAN1ONE
1630831069
91640455
InChI=1SC21H25N5O4c2719(73822212394102421)25111326(141225)20(28)18152916512617(16)3018h124691018H3781115H2(H222324)
MFCD28367859
ZINC000044865497
ZINC000044865501

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Available files

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