Vitas-M small molecule compound

1,1'-(1,4-diazepane-1,4-diyl)bis(2-phenoxybutan-1-one)

Catalog ID
STK413703
SMILES CCC(C(=O)N1CCCN(CC1)C(=O)C(Oc1ccccc1)CC)Oc1ccccc1

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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 C25H32N2O4 MW 424.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O4/c1-3-22(30-20-12-7-5-8-13-20)24(28)26-16-11-17-27(19-18-26)25(29)23(4-2)31-21-14-9-6-10-15-21/h5-10,12-15,22-23H,3-4,11,16-19H2,1-2H3
InChIKey
INFFMRSDOLSMMZ-UHFFFAOYSA-N
Synonyms

11(14diazepane14diyl)bis(2phenoxybutan1one)
2PHENOXY1(4(2PHENOXYBUTANOYL)(14DIAZAPERHYDROEPINYL))BUTAN1ONE
2PHENOXY1(4(2PHENOXYBUTANOYL)14DIAZEPAN1YL)BUTAN1ONE
CCC(C(=O)N1CCCN(CC1)C(=O)C(CC)OC2=CC=CC=C2)OC3=CC=CC=C3
InChI=1SC25H32N2O4c1322(3020127581320)24(28)2616111727(191826)25(29)23(42)31211496101521h51012152223H34111619H212H3
MFCD01107320
ZINC000005467595
ZINC000014643573

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Available files

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