Vitas-M small molecule compound

methyl 6-methyl-2-[4-(propan-2-yl)phenyl]quinoline-4-carboxylate

Catalog ID
STK431086
SMILES COC(=O)c1cc(nc2c1cc(C)cc2)c1ccc(cc1)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 C21H21NO2 MW 319.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO2/c1-13(2)15-6-8-16(9-7-15)20-12-18(21(23)24-4)17-11-14(3)5-10-19(17)22-20/h5-13H,1-4H3
InChIKey
XZNGIIUOZUZTTL-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OC)C3=CC=C(C=C3)C(C)C
InChI=1SC21H21NO2c113(2)156816(9715)201218(21(23)244)171114(3)51019(17)2220h513H14H3
METHYL2(4ISOPROPYLPHENYL)6METHYL4QUINOLINECARBOXYLATE
METHYL6METHYL2(4(METHYLETHYL)PHENYL)QUINOLINE4CARBOXYLATE
methyl6methyl2(4(propan2yl)phenyl)quinoline4carboxylate
METHYL6METHYL2(4PROPAN2YLPHENYL)QUINOLINE4CARBOXYLATE
MFCD03074508
ZINC000000373429
ZINC00373429
ZINC373429

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Available files

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