Vitas-M small molecule compound

1-oxo-1-phenylpropan-2-yl 6-methyl-2-[4-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl]quinoline-4-carboxylate

Catalog ID
STK383635
SMILES Cc1ccc2c(c1)c(cc(n2)c1ccc(cc1)N1C(=O)C2C(C1=O)C(C)C=CC2)C(=O)OC(C(=O)c1ccccc1)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 C35H30N2O5 MW 558.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30N2O5/c1-20-12-17-29-27(18-20)28(35(41)42-22(3)32(38)24-9-5-4-6-10-24)19-30(36-29)23-13-15-25(16-14-23)37-33(39)26-11-7-8-21(2)31(26)34(37)40/h4-10,12-19,21-22,26,31H,11H2,1-3H3
InChIKey
NZCBMRVVFXRCSR-UHFFFAOYSA-N
Synonyms

(1OXO1PHENYLPROPAN2YL)6METHYL2(4(4METHYL13DIOXO3A477ATETRAHYDROISOINDOL2YL)PHENYL)QUINOLINE4CARBOXYLATE
1METHYL2OXO2PHENYLETHYL6METHYL2(4(4METHYL13DIOXO(473A7ATETRAHYDROISOINDOL2YL))PHENYL)QUINOLINE4CARBOXYLATE
1oxo1phenylpropan2yl6methyl2(4(4methyl13dioxo133a477ahexahydro2Hisoindol2yl)phenyl)quinoline4carboxylate
CC1C=CCC2C1C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=C(C=C(C=C5)C)C(=C4)C(=O)OC(C)C(=O)C6=CC=CC=C6
InChI=1SC35H30N2O5c12012172927(1820)28(35(41)4222(3)32(38)2495461024)1930(3629)23131525(161423)3733(39)26117821(2)31(26)34(37)40h410121921222631H11H213H3
MFCD03649027
ZINC000102091118
ZINC000239165335

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Available files

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