Vitas-M small molecule compound

Catalog ID
STK613110
SMILES CCC([C@@H](C(=O)O)NC(=O)N1CCc2c(C1c1ccc(cc1)F)cc(c(c2)OC)OC)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 C24H29FN2O5 MW 444.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29FN2O5/c1-5-14(2)21(23(28)29)26-24(30)27-11-10-16-12-19(31-3)20(32-4)13-18(16)22(27)15-6-8-17(25)9-7-15/h6-9,12-14,21-22H,5,10-11H2,1-4H3,(H,26,30)(H,28,29)/t14?,21-,22?/m0/s1
InChIKey
CAMGOSGJNOVRHC-SZQATKJGSA-N
Synonyms
1013755-17-3
(2S)2((1(4fluorophenyl)67dimethoxy34dihydro1Hisoquinoline2carbonyl)amino)3methylpentanoicacid
(2S3R)2(1(4fluorophenyl)67dimethoxy1234tetrahydroisoquinoline2carboxamido)3methylpentanoicacid
1013755173
CCC((C@@H)(C(=O)O)NC(=O)N1CCc2c(C1c1ccc(cc1)F)cc(c(c2)OC)OC)C
CCC(C)C(C(=O)O)NC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=C(C=C3)F)OC)OC
InChI=1SC24H29FN2O5c1514(2)21(23(28)29)2624(30)271110161219(313)20(324)1318(16)22(27)156817(25)9715h6912142122H51011H214H3(H2630)(H2829)t14?2122?m0s1
ZINC000009059512
ZINC000013610127

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Available files

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