Vitas-M small molecule compound

4-(azepan-1-yl)-2-(3-nitrophenyl)quinazoline

Catalog ID
STK839334
SMILES [O-][N+](=O)c1cccc(c1)c1nc2ccccc2c(n1)N1CCCCCC1

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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 C20H20N4O2 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2/c25-24(26)16-9-7-8-15(14-16)19-21-18-11-4-3-10-17(18)20(22-19)23-12-5-1-2-6-13-23/h3-4,7-11,14H,1-2,5-6,12-13H2
InChIKey
KBBPPCOGPLZIGU-UHFFFAOYSA-N
Synonyms
369396-08-7
(O)(N+)(=O)c1cccc(c1)c1nc2ccccc2c(n1)N1CCCCCC1
369396087
4(azepan1yl)2(3nitrophenyl)quinazoline
C1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC20H20N4O2c2524(26)1697815(1416)19211811431017(18)20(2219)231251261323h3471114H12561213H2
MFCD03000299
ZINC000000524352
ZINC00524352
ZINC524352

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Available files

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