Vitas-M small molecule compound

5-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-5,7-dihydro-1H-pyrrolo[2,3-d]pyrimidine-2,4,6(3H)-trione

Catalog ID
STK637534
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CC1C(=O)Nc2c1c(=O)n(c(=O)n2C)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 C22H25N5O6 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O6/c1-24-19-18(21(30)25(2)22(24)31)14(20(29)23-19)10-17(28)27-7-5-26(6-8-27)11-13-3-4-15-16(9-13)33-12-32-15/h3-4,9,14H,5-8,10-12H2,1-2H3,(H,23,29)
InChIKey
JUXGCSTWQOOPAL-UHFFFAOYSA-N
Synonyms
1010889-35-6
1010889356
5(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethyl)13dimethyl57dihydro1Hpyrrolo(23d)pyrimidine246(3H)trione
5(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethyl)13dimethyl57dihydropyrrolo(23d)pyrimidine246trione
5(2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)2oxoethyl)13dimethyl1Hpyrrolo(23d)pyrimidine246(3H5H7H)trione
CN1C2=C(C(C(=O)N2)CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C(=O)N(C1=O)C
InChI=1SC22H25N5O6c1241918(21(30)25(2)22(24)31)14(20(29)2319)1017(28)277526(6827)1113341516(913)33123215h34914H581012H212H3(H2329)
MFCD12203433
ZINC000020678082
ZINC000101544992

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Available files

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