Vitas-M small molecule compound
3,5-bis{[(2,5-dimethylphenoxy)acetyl]amino}benzoic acid
Catalog ID
STK223581
SMILES O=C(Nc1cc(NC(=O)COc2cc(C)ccc2C)cc(c1)C(=O)O)COc1cc(C)ccc1C
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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 C27H28N2O6 MW 476.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O6/c1-16-5-7-18(3)23(9-16)34-14-25(30)28-21-11-20(27(32)33)12-22(13-21)29-26(31)15-35-24-10-17(2)6-8-19(24)4/h5-13H,14-15H2,1-4H3,(H,28,30)(H,29,31)(H,32,33)InChIKey
BXDKVYDOMKLGTB-UHFFFAOYSA-NSynonyms
35bis(((25dimethylphenoxy)acetyl)amino)benzoicacid
35BIS((2(25DIMETHYLPHENOXY)ACETYL)AMINO)BENZOICACID
CC1=CC(=C(C=C1)C)OCC(=O)NC2=CC(=CC(=C2)C(=O)O)NC(=O)COC3=C(C=CC(=C3)C)C
InChI=1SC27H28N2O6c1165718(3)23(916)341425(30)28211120(27(32)33)1222(1321)2926(31)1535241017(2)6819(24)4h513H1415H214H3(H2830)(H2931)(H3233)
MFCD02767106
ZINC000010060524
ZINC10060524
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