Vitas-M small molecule compound

10-hexanoyl-11-(3-methoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK326537
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)OC)C(=O)CC(C2)(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 C28H34N2O3 MW 446.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O3/c1-5-6-7-15-25(32)30-23-14-9-8-13-21(23)29-22-17-28(2,3)18-24(31)26(22)27(30)19-11-10-12-20(16-19)33-4/h8-14,16,27,29H,5-7,15,17-18H2,1-4H3
InChIKey
SWEXRNUITMYTMM-UHFFFAOYSA-N
Synonyms
371235-80-2
10hexanoyl11(3methoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
371235802
5hexanoyl6(3methoxyphenyl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC(=CC=C4)OC
InChI=1SC28H34N2O3c15671525(32)302314981321(23)29221728(23)1824(31)26(22)27(30)1911101220(1619)334h814162729H57151718H214H3
MFCD01921847
ZINC000009300557
ZINC000009300559

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Available files

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