Vitas-M small molecule compound

3-benzyl-2-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-6-iodoquinazolin-4(3H)-one

Catalog ID
STK544784
SMILES Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)N(C)C)Cc1ccccc1

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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 C25H22IN3O MW 507.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22IN3O/c1-28(2)21-12-8-18(9-13-21)10-15-24-27-23-14-11-20(26)16-22(23)25(30)29(24)17-19-6-4-3-5-7-19/h3-16H,17H2,1-2H3/b15-10+
InChIKey
YHFUCCNDZGXAGL-XNTDXEJSSA-N
Synonyms
384796-12-7
(E)3benzyl2(4(dimethylamino)styryl)6iodoquinazolin4(3H)one
384796127
3benzyl2((E)2(4(dimethylamino)phenyl)ethenyl)6iodoquinazolin4(3H)one
3benzyl2((E)2(4(dimethylamino)phenyl)ethenyl)6iodoquinazolin4one
3BENZYL2((E)2(4DIMETHYLAMINOPHENYL)ETHENYL)6IODOQUINAZOLIN4ONE
CN(C)C1=CC=C(C=C1)C=CC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4
Ic1ccc2c(c1)c(=O)n(c(n2)C=Cc1ccc(cc1)N(C)C)Cc1ccccc1
InChI=1SC25H22IN3Oc128(2)2112818(91321)1015242723141120(26)1622(23)25(30)29(24)17196435719h316H17H212H3b1510+
MFCD03192452
ZINC000009086437
ZINC09086437
ZINC9086437

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Available files

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