Vitas-M small molecule compound

cyclohexylmethyl 4-[2-(benzyloxy)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK020231
SMILES O=C1NC(=C(C(N1)c1ccccc1OCc1ccccc1)C(=O)OCC1CCCCC1)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 C26H30N2O4 MW 434.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O4/c1-18-23(25(29)32-17-20-12-6-3-7-13-20)24(28-26(30)27-18)21-14-8-9-15-22(21)31-16-19-10-4-2-5-11-19/h2,4-5,8-11,14-15,20,24H,3,6-7,12-13,16-17H2,1H3,(H2,27,28,30)
InChIKey
KGZGREMIGCIBBO-UHFFFAOYSA-N
Synonyms

CC1=C(C(NC(=O)N1)C2=CC=CC=C2OCC3=CC=CC=C3)C(=O)OCC4CCCCC4
cyclohexylmethyl4(2(benzyloxy)phenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOHEXYLMETHYL4METHYL2OXO6(2(PHENYLMETHOXY)PHENYL)136TRIHYDROPYRIMIDINE5CARBOXYLATE
CYCLOHEXYLMETHYL6METHYL2OXO4(2PHENYLMETHOXYPHENYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC26H30N2O4c11823(25(29)321720126371320)24(2826(30)2718)2114891522(21)311619104251119h24581114152024H36712131617H21H3(H2272830)
MFCD01193640
O=C1NC(=C(C(N1)c1ccccc1OCc1ccccc1)C(=O)OCC1CCCCC1)C
STK020231
ZINC000000844507
ZINC000008407987

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Available files

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