Vitas-M small molecule compound
4-oxo-4-(phenylamino)-2-({4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl}methyl)butanoic acid
Catalog ID
STL245658
SMILES O=C(CC(C(=O)O)CN1CCCN(CC1)c1ccc(cn1)C(F)(F)F)Nc1ccccc1
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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 C22H25F3N4O3 MW 450.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25F3N4O3/c23-22(24,25)17-7-8-19(26-14-17)29-10-4-9-28(11-12-29)15-16(21(31)32)13-20(30)27-18-5-2-1-3-6-18/h1-3,5-8,14,16H,4,9-13,15H2,(H,27,30)(H,31,32)InChIKey
LZQGZZMFYXHDIZ-UHFFFAOYSA-NSynonyms
1324064-39-21324064392
4anilino4oxo2((4(5(trifluoromethyl)pyridin2yl)14diazepan1yl)methyl)butanoicacid
4oxo4(phenylamino)2((4(5(trifluoromethyl)pyridin2yl)14diazepan1yl)methyl)butanoicacid
C1CN(CCN(C1)C2=NC=C(C=C2)C(F)(F)F)CC(CC(=O)NC3=CC=CC=C3)C(=O)O
InChI=1SC22H25F3N4O3c2322(2425)177819(261417)29104928(111229)1516(21(31)32)1320(30)27185213618h13581416H491315H2(H2730)(H3132)
MFCD19711751
ZINC000071285341
ZINC000071285342
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