Vitas-M small molecule compound

methyl N-(3-cyclohexylpropanoyl)-3,3,3-trifluoro-2-[(tetrahydrofuran-2-ylmethyl)amino]alaninate

Catalog ID
STK771809
SMILES COC(=O)C(C(F)(F)F)(NC(=O)CCC1CCCCC1)NCC1CCCO1

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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 C18H29F3N2O4 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H29F3N2O4/c1-26-16(25)17(18(19,20)21,22-12-14-8-5-11-27-14)23-15(24)10-9-13-6-3-2-4-7-13/h13-14,22H,2-12H2,1H3,(H,23,24)
InChIKey
VZURSNFNPHEJLE-UHFFFAOYSA-N
Synonyms
681839-08-7
681839087
COC(=O)C(C(F)(F)F)(NCC1CCCO1)NC(=O)CCC2CCCCC2
InChI=1SC18H29F3N2O4c12616(25)17(18(1920)2122121485112714)2315(24)109136324713h131422H212H21H3(H2324)
methyl2(3cyclohexylpropanamido)333trifluoro2(((tetrahydrofuran2yl)methyl)amino)propanoate
METHYL2(3CYCLOHEXYLPROPANOYLAMINO)333TRIFLUORO2(OXOLAN2YLMETHYLAMINO)PROPANOATE
methylN(3cyclohexylpropanoyl)333trifluoro2((tetrahydrofuran2ylmethyl)amino)alaninate
MFCD03767642
ZINC000019848876
ZINC000019848879

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Available files

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