Vitas-M small molecule compound

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

Catalog ID
STK129690
SMILES COc1cccc(c1OC)C1C2=C(Nc3c(N1C(=O)C(F)(F)F)cccc3)CC(CC2=O)(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 C25H25F3N2O4 MW 474.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25F3N2O4/c1-24(2)12-16-20(18(31)13-24)21(14-8-7-11-19(33-3)22(14)34-4)30(23(32)25(26,27)28)17-10-6-5-9-15(17)29-16/h5-11,21,29H,12-13H2,1-4H3
InChIKey
BLYNKRXGSRMZCK-UHFFFAOYSA-N
Synonyms
353785-16-7
11(23dimethoxyphenyl)33dimethyl10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(23dimethoxyphenyl)33dimethyl10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
353785167
6(23dimethoxyphenyl)99dimethyl5(222trifluoroacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C(F)(F)F)C4=C(C(=CC=C4)OC)OC)C(=O)C1)C
InChI=1SC25H25F3N2O4c124(2)121620(18(31)1324)21(14871119(333)22(14)344)30(23(32)25(2627)28)171065915(17)2916h5112129H1213H214H3
MFCD01920630
ZINC000018179680
ZINC000018179683

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Available files

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