Vitas-M small molecule compound

3-{[2-(4-tert-butylphenyl)quinazolin-4-yl]amino}benzoic acid

Catalog ID
STK969076
SMILES OC(=O)c1cccc(c1)Nc1nc(nc2c1cccc2)c1ccc(cc1)C(C)(C)C

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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 C25H23N3O2 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O2/c1-25(2,3)18-13-11-16(12-14-18)22-27-21-10-5-4-9-20(21)23(28-22)26-19-8-6-7-17(15-19)24(29)30/h4-15H,1-3H3,(H,29,30)(H,26,27,28)
InChIKey
FUNUMXBFOGEJLU-UHFFFAOYSA-N
Synonyms

3((2(4(TERTBUTYL)PHENYL)QUINAZOLIN4YL)AMINO)BENZOICACID
3((2(4tertbutylphenyl)quinazolin4yl)amino)benzoicacid
CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC=CC(=C4)C(=O)O
InChI=1SC25H23N3O2c125(23)18131116(121418)2227211054920(21)23(2822)261986717(1519)24(29)30h415H13H3(H2930)(H262728)
MFCD03286231
ZINC000001756694
ZINC1756694

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Available files

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