Vitas-M small molecule compound

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

Catalog ID
STL027650
SMILES CCOC(=O)C1=C(CN2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)NC1c1ccccc1

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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 C23H32N4O5 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N4O5/c1-5-31-20(28)18-17(24-21(29)25-19(18)16-9-7-6-8-10-16)15-26-11-13-27(14-12-26)22(30)32-23(2,3)4/h6-10,19H,5,11-15H2,1-4H3,(H2,24,25,29)
InChIKey
VOFWWAQAQSYROK-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN3CCN(CC3)C(=O)OC(C)(C)C
ethyl6((4((2methylpropan2yl)oxycarbonyl)piperazin1yl)methyl)2oxo4phenyl34dihydro1Hpyrimidine5carboxylate
ethyl6((4(tertbutoxycarbonyl)piperazin1yl)methyl)2oxo4phenyl1234tetrahydropyrimidine5carboxylate
InChI=1SC23H32N4O5c153120(28)1817(2421(29)2519(18)1697681016)1526111327(141226)22(30)3223(23)4h61019H51115H214H3(H2242529)
MFCD18188269
ZINC000026912367
ZINC000026912371

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Available files

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