Vitas-M small molecule compound

ethyl 6-(azepan-1-ylmethyl)-4-(4-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK683821
SMILES CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)NC1c1ccc(cc1)Cl

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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 C20H26ClN3O3 MW 391.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26ClN3O3/c1-2-27-19(25)17-16(13-24-11-5-3-4-6-12-24)22-20(26)23-18(17)14-7-9-15(21)10-8-14/h7-10,18H,2-6,11-13H2,1H3,(H2,22,23,26)
InChIKey
HAGRHDHXBGGFJA-UHFFFAOYSA-N
Synonyms
696650-54-1
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)CN3CCCCCC3
ethyl6(azepan1ylmethyl)4(4chlorophenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6(AZEPAN1YLMETHYL)4(4CHLOROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
Registry IDs
MFCD05258785
ZINC000055226520
ZINC000055226522

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Available files

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