Vitas-M small molecule compound

ethyl 6-{[4-(ethoxycarbonyl)piperazin-1-yl]methyl}-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL107873
SMILES CCOC(=O)C1=C(CN2CCN(CC2)C(=O)OCC)NC(=O)NC1c1ccccc1OC

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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 C22H30N4O6 MW 446.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O6/c1-4-31-20(27)18-16(14-25-10-12-26(13-11-25)22(29)32-5-2)23-21(28)24-19(18)15-8-6-7-9-17(15)30-3/h6-9,19H,4-5,10-14H2,1-3H3,(H2,23,24,28)
InChIKey
BCGIJCQQRMZVCV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OC)CN3CCN(CC3)C(=O)OCC
ethyl6((4(ethoxycarbonyl)piperazin1yl)methyl)4(2methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4ethoxycarbonylpiperazin1yl)methyl)4(2methoxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC22H30N4O6c143120(27)1816(1425101226(131125)22(29)3252)2321(28)2419(18)15867917(15)303h6919H451014H213H3(H2232428)
MFCD20741779
ZINC000067287600
ZINC000067287602

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Available files

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