Vitas-M small molecule compound

methyl N-({4-[2-(trifluoromethoxy)phenyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl}carbonyl)phenylalaninate

Catalog ID
STL236117
SMILES COC(=O)C(NC(=O)N1CCc2c(C1c1ccccc1OC(F)(F)F)[nH]cn2)Cc1ccccc1

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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 C24H23F3N4O4 MW 488.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23F3N4O4/c1-34-22(32)18(13-15-7-3-2-4-8-15)30-23(33)31-12-11-17-20(29-14-28-17)21(31)16-9-5-6-10-19(16)35-24(25,26)27/h2-10,14,18,21H,11-13H2,1H3,(H,28,29)(H,30,33)
InChIKey
JJMKZHGHCYFEMC-UHFFFAOYSA-N
Synonyms

(2S)methyl3phenyl2(4(2(trifluoromethoxy)phenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)propanoate
COC(=O)(C@@H)(NC(=O)N1CCc2c(C1c1ccccc1OC(F)(F)F)(nH)cn2)Cc1ccccc1
COC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCC3=C(C2C4=CC=CC=C4OC(F)(F)F)N=CN3
COC(=O)C(NC(=O)N1CCc2c(C1c1ccccc1OC(F)(F)F)(nH)cn2)Cc1ccccc1
InChI=1SC24H23F3N4O4c13422(32)18(13157324815)3023(33)3112111720(29142817)21(31)169561019(16)3524(2526)27h210141821H1113H21H3(H2829)(H3033)
methyl3phenyl2((4(2(trifluoromethoxy)phenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)propanoate
methylN((4(2(trifluoromethoxy)phenyl)3467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)phenylalaninate
MFCD24858604
ZINC000020714937
ZINC000036575883

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Available files

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