Vitas-M small molecule compound

4-(4-methoxyphenyl)-2,7,7-trimethyl-3-(piperidin-1-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one

Catalog ID
STK373101
SMILES COc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)N1CCCCC1

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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 C25H32N2O3 MW 408.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O3/c1-16-21(24(29)27-12-6-5-7-13-27)22(17-8-10-18(30-4)11-9-17)23-19(26-16)14-25(2,3)15-20(23)28/h8-11,22,26H,5-7,12-15H2,1-4H3
InChIKey
PAFORFODQVWLDI-UHFFFAOYSA-N
Synonyms

4(4methoxyphenyl)277trimethyl3(piperidin1ylcarbonyl)4678tetrahydroquinolin5(1H)one
4(4methoxyphenyl)277trimethyl3(piperidine1carbonyl)1468tetrahydroquinolin5one
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)OC)C(=O)N4CCCCC4
InChI=1SC25H32N2O3c11621(24(29)27126571327)22(1781018(304)11917)2319(2616)1425(23)1520(23)28h8112226H571215H214H3
MFCD00718027
ZINC000003073721
ZINC000003073722

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Available files

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