Vitas-M small molecule compound

propan-2-yl 2,7,7-trimethyl-5-oxo-4-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK097721
SMILES CC(OC(=O)C1=C(C)NC2=C(C1c1ccccn1)C(=O)CC(C2)(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 C21H26N2O3 MW 354.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3/c1-12(2)26-20(25)17-13(3)23-15-10-21(4,5)11-16(24)18(15)19(17)14-8-6-7-9-22-14/h6-9,12,19,23H,10-11H2,1-5H3
InChIKey
VFYGBBGWINROOO-UHFFFAOYSA-N
Synonyms
297158-07-7
297158077
CC(OC(=O)C1=C(C)NC2=C(C1c1ccccn1)C(=O)CC(C2)(C)C)C
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CC=N3)C(=O)OC(C)C
InChI=1SC21H26N2O3c112(2)2620(25)1713(3)23151021(45)1116(24)18(15)19(17)1486792214h69121923H1011H215H3
MFCD00753012
propan2yl277trimethyl5oxo4(pyridin2yl)145678hexahydroquinoline3carboxylate
propan2yl277trimethyl5oxo4pyridin2yl1468tetrahydroquinoline3carboxylate
STK097721
ZINC000013285519
ZINC000013285520

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Available files

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