Vitas-M small molecule compound

methyl N-{[4-(4-chloro-2-fluorophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}-L-alaninate

Catalog ID
STK650255
SMILES COC(=O)[C@@H](NC(=O)N1CCc2c(C1c1ccc(cc1F)Cl)nc[nH]2)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 C17H18ClFN4O3 MW 380.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClFN4O3/c1-9(16(24)26-2)22-17(25)23-6-5-13-14(21-8-20-13)15(23)11-4-3-10(18)7-12(11)19/h3-4,7-9,15H,5-6H2,1-2H3,(H,20,21)(H,22,25)/t9-,15?/m0/s1
InChIKey
KXOMIGIKZKSVSE-HJULIUOESA-N
Synonyms
1212435-58-9
(2S)methyl2(4(4chloro2fluorophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)propanoate
1212435589
CC(C(=O)OC)NC(=O)N1CCC2=C(C1C3=C(C=C(C=C3)Cl)F)N=CN2
COC(=O)(C@@H)(NC(=O)N1CCc2c(C1c1ccc(cc1F)Cl)(nH)cn2)C
COC(=O)(C@@H)(NC(=O)N1CCc2c(C1c1ccc(cc1F)Cl)nc(nH)2)C
InChI=1SC17H18ClFN4O3c19(16(24)262)2217(25)23651314(2182013)15(23)114310(18)712(11)19h347915H56H212H3(H2021)(H2225)t915?m0s1
methyl(2S)2((4(4chloro2fluorophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)propanoate
methylN((4(4chloro2fluorophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)Lalaninate
MFCD18165552
ZINC000031810395
ZINC000031810405

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Available files

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