Vitas-M small molecule compound

11-(4-methylphenyl)-10-propanoyl-3-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK133221
SMILES CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)C)C(=O)CC(C2)c1cc(OC)c(c(c1)OC)OC

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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 C32H34N2O5 MW 526.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O5/c1-6-29(36)34-25-10-8-7-9-23(25)33-24-15-21(22-17-27(37-3)32(39-5)28(18-22)38-4)16-26(35)30(24)31(34)20-13-11-19(2)12-14-20/h7-14,17-18,21,31,33H,6,15-16H2,1-5H3
InChIKey
KNYOBDIQBQFVLJ-UHFFFAOYSA-N
Synonyms
351164-87-9
10propionyl11(ptolyl)3(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4methylphenyl)10propanoyl3(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
351164879
6(4methylphenyl)5propanoyl9(345trimethoxyphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC(=C(C(=C3)OC)OC)OC)NC4=CC=CC=C41)C5=CC=C(C=C5)C
InChI=1SC32H34N2O5c1629(36)34251087923(25)33241521(221727(373)32(395)28(1822)384)1626(35)30(24)31(34)20131119(2)121420h7141718213133H61516H215H3
MFCD01948613
ZINC000018180898
ZINC000018180905

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Available files

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