Vitas-M small molecule compound

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

Catalog ID
STK095446
SMILES CCCCOc1ccccc1C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(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 C31H34N2O4 MW 498.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O4/c1-4-5-16-37-27-13-9-6-10-22(27)31-30-25(32-23-11-7-8-12-24(23)33-31)17-21(18-26(30)34)20-14-15-28(35-2)29(19-20)36-3/h6-15,19,21,31-33H,4-5,16-18H2,1-3H3
InChIKey
XBFJCGNIGDUVKW-UHFFFAOYSA-N
Synonyms

11(2butoxyphenyl)3(34dimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(34DIMETHOXYPHENYL)11(2BUTOXYPHENYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
6(2butoxyphenyl)9(34dimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCCCOC1=CC=CC=C1C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC5=CC=CC=C5N2
CCCCOc1ccccc1C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(c(c1)OC)OC
InChI=1SC31H34N2O4c14516372713961022(27)313025(322311781224(23)3331)1721(1826(30)34)20141528(352)29(1920)363h61519213133H451618H213H3
MFCD02104504
STK095446
ZINC000004082801
ZINC000004082823

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Available files

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