Vitas-M small molecule compound

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

Catalog ID
STK938924
SMILES COC(=O)[C@H](C(C)C)NC(=O)N1CCc2c(C1c1ccc(c(c1)Br)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 C19H22BrFN4O3 MW 453.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22BrFN4O3/c1-10(2)15(18(26)28-3)24-19(27)25-7-6-14-16(23-9-22-14)17(25)11-4-5-13(21)12(20)8-11/h4-5,8-10,15,17H,6-7H2,1-3H3,(H,22,23)(H,24,27)/t15-,17?/m0/s1
InChIKey
WIIYUHAYBZVSJB-MYJWUSKBSA-N
Synonyms
1491144-52-5
(2S)methyl2(4(3bromo4fluorophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)3methylbutanoate
1491144525
CC(C)C(C(=O)OC)NC(=O)N1CCC2=C(C1C3=CC(=C(C=C3)F)Br)N=CN2
COC(=O)(C@H)(C(C)C)NC(=O)N1CCc2c(C1c1ccc(c(c1)Br)F)(nH)cn2
COC(=O)(C@H)(C(C)C)NC(=O)N1CCc2c(C1c1ccc(c(c1)Br)F)nc(nH)2
InChI=1SC19H22BrFN4O3c110(2)15(18(26)283)2419(27)25761416(2392214)17(25)114513(21)12(20)811h458101517H67H213H3(H2223)(H2427)t1517?m0s1
methyl(2S)2((4(3bromo4fluorophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)3methylbutanoate
methylN((4(3bromo4fluorophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)Lvalinate
MFCD18179102
ZINC000040288103
ZINC000040288104

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Available files

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