Vitas-M small molecule compound

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

Catalog ID
STK935189
SMILES COC(=O)CCCCCNC(=O)N1CCc2c(C1c1cccc(c1)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 C20H25FN4O3 MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25FN4O3/c1-28-17(26)8-3-2-4-10-22-20(27)25-11-9-16-18(24-13-23-16)19(25)14-6-5-7-15(21)12-14/h5-7,12-13,19H,2-4,8-11H2,1H3,(H,22,27)(H,23,24)
InChIKey
CCGQVPLVHYCBEF-UHFFFAOYSA-N
Synonyms
1040695-53-1
1040695531
COC(=O)CCCCCNC(=O)N1CCC2=C(C1C3=CC(=CC=C3)F)N=CN2
COC(=O)CCCCCNC(=O)N1CCc2c(C1c1cccc(c1)F)(nH)cn2
COC(=O)CCCCCNC(=O)N1CCc2c(C1c1cccc(c1)F)nc(nH)2
InChI=1SC20H25FN4O3c12817(26)8324102220(27)251191618(24132316)19(25)1465715(21)1214h57121319H24811H21H3(H2227)(H2324)
methyl6(((4(3fluorophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)amino)hexanoate
methyl6((4(3fluorophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)hexanoate
methyl6(4(3fluorophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)hexanoate
MFCD18178000
ZINC000040268785
ZINC000040268787

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Available files

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