Vitas-M small molecule compound

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

Catalog ID
STK639788
SMILES COC(=O)[C@@H](NC(=O)N1CCc2c(C1c1ccc(c(c1F)F)F)nc[nH]2)CC(C)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 C20H23F3N4O3 MW 424.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23F3N4O3/c1-10(2)8-14(19(28)30-3)26-20(29)27-7-6-13-17(25-9-24-13)18(27)11-4-5-12(21)16(23)15(11)22/h4-5,9-10,14,18H,6-8H2,1-3H3,(H,24,25)(H,26,29)/t14-,18?/m0/s1
InChIKey
PYFMREOTJIPHOB-PIVQAISJSA-N
Synonyms
1212471-03-8
(2S)methyl4methyl2(4(234trifluorophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)pentanoate
1212471038
CC(C)CC(C(=O)OC)NC(=O)N1CCC2=C(C1C3=C(C(=C(C=C3)F)F)F)N=CN2
COC(=O)(C@@H)(NC(=O)N1CCc2c(C1c1ccc(c(c1F)F)F)(nH)cn2)CC(C)C
COC(=O)(C@@H)(NC(=O)N1CCc2c(C1c1ccc(c(c1F)F)F)nc(nH)2)CC(C)C
InChI=1SC20H23F3N4O3c110(2)814(19(28)303)2620(29)27761317(2592413)18(27)114512(21)16(23)15(11)22h459101418H68H213H3(H2425)(H2629)t1418?m0s1
methyl(2S)4methyl2((4(234trifluorophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)pentanoate
methylN((4(234trifluorophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)Lleucinate
MFCD18162122
ZINC000020734451
ZINC000020734454

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Available files

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