Vitas-M small molecule compound

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

Catalog ID
STK932560
SMILES COC(=O)c1cc(F)ccc1NC(=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 C21H17F3N4O3 MW 430.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F3N4O3/c1-31-20(29)13-9-11(22)5-6-15(13)27-21(30)28-8-7-16-18(26-10-25-16)19(28)12-3-2-4-14(23)17(12)24/h2-6,9-10,19H,7-8H2,1H3,(H,25,26)(H,27,30)
InChIKey
AAOWJLXITPPMDP-UHFFFAOYSA-N
Synonyms
1219551-28-6
1219551286
COC(=O)C1=C(C=CC(=C1)F)NC(=O)N2CCC3=C(C2C4=C(C(=CC=C4)F)F)N=CN3
COC(=O)c1cc(F)ccc1NC(=O)N1CCc2c(C1c1cccc(c1F)F)(nH)cn2
COC(=O)c1cc(F)ccc1NC(=O)N1CCc2c(C1c1cccc(c1F)F)nc(nH)2
InChI=1SC21H17F3N4O3c13120(29)13911(22)5615(13)2721(30)28871618(26102516)19(28)1232414(23)17(12)24h2691019H78H21H3(H2526)(H2730)
methyl2(((4(23difluorophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)amino)5fluorobenzoate
methyl2((4(23difluorophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)5fluorobenzoate
methyl2(4(23difluorophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)5fluorobenzoate
MFCD18177275
ZINC000040267000
ZINC000040267001

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Available files

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