Vitas-M small molecule compound

methyl 4-(1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK373106
SMILES COC(=O)C1=C(C)N(C(=O)NC1c1ccc2c(c1)OCO2)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 C15H16N2O5 MW 304.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N2O5/c1-8-12(14(18)20-3)13(16-15(19)17(8)2)9-4-5-10-11(6-9)22-7-21-10/h4-6,13H,7H2,1-3H3,(H,16,19)
InChIKey
KUDRBJCDTCKBDK-UHFFFAOYSA-N
Synonyms
300570-99-4
300570994
CC1=C(C(NC(=O)N1C)C2=CC3=C(C=C2)OCO3)C(=O)OC
InChI=1SC15H16N2O5c1812(14(18)203)13(1615(19)17(8)2)9451011(69)2272110h4613H7H213H3(H1619)
methyl4(13benzodioxol5yl)16dimethyl2oxo1234tetrahydropyrimidine5carboxylate
METHYL6(13BENZODIOXOL5YL)34DIMETHYL2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
MFCD00548130
ZINC000000195110
ZINC000000195111

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.