Vitas-M small molecule compound

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

Catalog ID
STK639855
SMILES CC[C@H]([C@@H](C(=O)OC)NC(=O)N1CCc2c(C1c1cc(F)ccc1F)nc[nH]2)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 C20H24F2N4O3 MW 406.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24F2N4O3/c1-4-11(2)16(19(27)29-3)25-20(28)26-8-7-15-17(24-10-23-15)18(26)13-9-12(21)5-6-14(13)22/h5-6,9-11,16,18H,4,7-8H2,1-3H3,(H,23,24)(H,25,28)/t11-,16+,18?/m1/s1
InChIKey
UBWJAGVBILKOBT-HJHRRKNKSA-N
Synonyms
1491141-35-5
(2S3R)methyl2(4(25difluorophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)3methylpentanoate
1491141355
CC(C@H)((C@@H)(C(=O)OC)NC(=O)N1CCc2c(C1c1cc(F)ccc1F)(nH)cn2)C
CC(C@H)((C@@H)(C(=O)OC)NC(=O)N1CCc2c(C1c1cc(F)ccc1F)nc(nH)2)C
CCC(C)C(C(=O)OC)NC(=O)N1CCC2=C(C1C3=C(C=CC(=C3)F)F)N=CN2
InChI=1SC20H24F2N4O3c1411(2)16(19(27)293)2520(28)26871517(24102315)18(26)13912(21)5614(13)22h569111618H478H213H3(H2324)(H2528)t1116+18?m1s1
methyl(2S3R)2((4(25difluorophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)3methylpentanoate
methylN((4(25difluorophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)Lisoleucinate
MFCD18162145
ZINC000020722591
ZINC000020722594

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Available files

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