Vitas-M small molecule compound

4-(benzyloxy)-N-[6-bromo-2-(2-hydroxy-5-nitrophenyl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzamide

Catalog ID
STL172656
SMILES Brc1ccc2c(c1)C(=O)N(C(N2)c1cc(ccc1O)[N+](=O)[O-])NC(=O)c1ccc(cc1)OCc1ccccc1

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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 C28H21BrN4O6 MW 589.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21BrN4O6/c29-19-8-12-24-22(14-19)28(36)32(26(30-24)23-15-20(33(37)38)9-13-25(23)34)31-27(35)18-6-10-21(11-7-18)39-16-17-4-2-1-3-5-17/h1-15,26,30,34H,16H2,(H,31,35)
InChIKey
IDNCGJNBTVSPSX-UHFFFAOYSA-N
Synonyms
438453-05-5
4(BENZYLOXY)N(6BROMO2(2HYDROXY5NITROPHENYL)4OXO14DIHYDRO3(2H)QUINAZOLINYL)BENZAMIDE
4(benzyloxy)N(6bromo2(2hydroxy5nitrophenyl)4oxo14dihydroquinazolin3(2H)yl)benzamide
438453055
Brc1ccc2c(c1)C(=O)N(C(N2)c1cc(ccc1O)(N+)(=O)(O))NC(=O)c1ccc(cc1)OCc1ccccc1
C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NN3C(NC4=C(C3=O)C=C(C=C4)Br)C5=C(C=CC(=C5)(N+)(=O)(O))O
InChI=1SC28H21BrN4O6c29198122422(1419)28(36)32(26(3024)231520(33(37)38)91325(23)34)3127(35)1861021(11718)3916174213517h115263034H16H2(H3135)
MFCD02053795
N(6BROMO2(2HYDROXY5NITROPHENYL)4OXO12DIHYDROQUINAZOLIN3YL)4PHENYLMETHOXYBENZAMIDE
ZINC000035973846
ZINC000035982169

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Available files

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