Vitas-M small molecule compound
methyl N-{[4-(2-fluoro-4-methoxyphenyl)-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}isoleucinate
Catalog ID
STL238849
SMILES CCC(C(C(=O)OC)NC(=O)N1CCc2c(C1c1ccc(cc1F)OC)[nH]cn2)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 C21H27FN4O4 MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27FN4O4/c1-5-12(2)17(20(27)30-4)25-21(28)26-9-8-16-18(24-11-23-16)19(26)14-7-6-13(29-3)10-15(14)22/h6-7,10-12,17,19H,5,8-9H2,1-4H3,(H,23,24)(H,25,28)InChIKey
LJWIGFTUPIHQJP-UHFFFAOYSA-NSynonyms
(2S3R)methyl2(4(2fluoro4methoxyphenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)3methylpentanoate
CC(C@H)((C@@H)(C(=O)OC)NC(=O)N1CCc2c(C1c1ccc(cc1F)OC)(nH)cn2)C
CCC(C(C(=O)OC)NC(=O)N1CCc2c(C1c1ccc(cc1F)OC)(nH)cn2)C
CCC(C)C(C(=O)OC)NC(=O)N1CCC2=C(C1C3=C(C=C(C=C3)OC)F)N=CN2
InChI=1SC21H27FN4O4c1512(2)17(20(27)304)2521(28)26981618(24112316)19(26)147613(293)1015(14)22h6710121719H589H214H3(H2324)(H2528)
methyl2((4(2fluoro4methoxyphenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)3methylpentanoate
methylN((4(2fluoro4methoxyphenyl)3467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)isoleucinate
MFCD24858853
ZINC000036584764
ZINC000252517554
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