Vitas-M small molecule compound

methyl N-{[4-(2,3-difluorophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}-beta-alaninate

Catalog ID
STK658713
SMILES COC(=O)CCNC(=O)N1CCc2c(C1c1cccc(c1F)F)nc[nH]2

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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 C17H18F2N4O3 MW 364.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18F2N4O3/c1-26-13(24)5-7-20-17(25)23-8-6-12-15(22-9-21-12)16(23)10-3-2-4-11(18)14(10)19/h2-4,9,16H,5-8H2,1H3,(H,20,25)(H,21,22)
InChIKey
FZUYCEXJMDRUAM-UHFFFAOYSA-N
Synonyms
1040702-31-5
1040702315
COC(=O)CCNC(=O)N1CCC2=C(C1C3=C(C(=CC=C3)F)F)N=CN2
COC(=O)CCNC(=O)N1CCc2c(C1c1cccc(c1F)F)(nH)cn2
COC(=O)CCNC(=O)N1CCc2c(C1c1cccc(c1F)F)nc(nH)2
InChI=1SC17H18F2N4O3c12613(24)572017(25)23861215(2292112)16(23)1032411(18)14(10)19h24916H58H21H3(H2025)(H2122)
methyl3((4(23difluorophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)propanoate
methyl3(4(23difluorophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)propanoate
methylN((4(23difluorophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)betaalaninate
MFCD18168471
ZINC000031810362
ZINC000031810369

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Available files

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