Vitas-M small molecule compound

tert-butyl 6-(2-chlorophenyl)-2-hydroxy-4-methyl-1,6-dihydropyrimidine-5-carboxylate

Catalog ID
STK641578
SMILES OC1=NC(=C(C(N1)c1ccccc1Cl)C(=O)OC(C)(C)C)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 C16H19ClN2O3 MW 322.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClN2O3/c1-9-12(14(20)22-16(2,3)4)13(19-15(21)18-9)10-7-5-6-8-11(10)17/h5-8,13H,1-4H3,(H2,18,19,21)
InChIKey
ZRNTVXPTHZVKRF-UHFFFAOYSA-N
Synonyms
488709-96-2
CC1=C(C(NC(=O)N1)C2=CC=CC=C2Cl)C(=O)OC(C)(C)C
InChI=1SC16H19ClN2O3c1912(14(20)2216(23)4)13(1915(21)189)10756811(10)17h5813H14H3(H2181921)
MFCD18162693
TERTBUTYL4(2CHLOROPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
tertbutyl6(2chlorophenyl)2hydroxy4methyl16dihydropyrimidine5carboxylate
ZINC000000458935
ZINC000000458937

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Available files

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