Vitas-M small molecule compound

N-(3-fluorophenyl)-2-[(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)oxy]acetamide

Catalog ID
STK643444
SMILES O=C(Nc1cccc(c1)F)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1

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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 C21H20FN3O3 MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O3/c22-14-5-4-6-15(11-14)23-20(26)13-28-16-8-9-18-17(12-16)21(27)25-10-3-1-2-7-19(25)24-18/h4-6,8-9,11-12H,1-3,7,10,13H2,(H,23,26)
InChIKey
IWJOPIYTVNNNND-UHFFFAOYSA-N
Synonyms
951966-46-4
951966464
C1CCC2=NC3=C(C=C(C=C3)OCC(=O)NC4=CC(=CC=C4)F)C(=O)N2CC1
InChI=1SC21H20FN3O3c221454615(1114)2320(26)132816891817(1216)21(27)2510312719(25)2418h46891112H1371013H2(H2326)
MFCD09857077
N(3fluorophenyl)2((12oxo67891012hexahydroazepino(21b)quinazolin2yl)oxy)acetamide
N(3fluorophenyl)2((12oxo78910tetrahydro6Hazepino(21b)quinazolin2yl)oxy)acetamide
ZINC000013728910
ZINC13728910

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Available files

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