Vitas-M small molecule compound

2-[(4-methyl-1,4-diazepan-1-yl)methyl]-4-oxo-4-(phenylamino)butanoic acid

Catalog ID
STL244045
SMILES CN1CCCN(CC1)CC(C(=O)O)CC(=O)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 C17H25N3O3 MW 319.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O3/c1-19-8-5-9-20(11-10-19)13-14(17(22)23)12-16(21)18-15-6-3-2-4-7-15/h2-4,6-7,14H,5,8-13H2,1H3,(H,18,21)(H,22,23)
InChIKey
YDJGLRLSBJKJDG-UHFFFAOYSA-N
Synonyms
1324091-52-2
1324091522
2((4methyl14diazepan1yl)methyl)4oxo4(phenylamino)butanoicacid
4anilino2((4methyl14diazepan1yl)methyl)4oxobutanoicacid
CN1CCCN(CC1)CC(CC(=O)NC2=CC=CC=C2)C(=O)O
InChI=1SC17H25N3O3c11985920(111019)1314(17(22)23)1216(21)18156324715h246714H5813H21H3(H1821)(H2223)
MFCD19711887
ZINC000071285551
ZINC000106714350

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Available files

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