Vitas-M small molecule compound

[11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-1-hydroxy-3-(4-methoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl](3,4,5-trimethoxyphenyl)methanone

Catalog ID
STK052769
SMILES CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1cc(OC)c(c(c1)OC)OC)cccc2)c1ccc(cc1)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 C45H43ClN2O8 MW 775.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C45H43ClN2O8/c1-6-55-39-23-29(15-20-38(39)56-26-27-11-16-32(46)17-12-27)43-42-35(21-30(22-37(42)49)28-13-18-33(51-2)19-14-28)47-34-9-7-8-10-36(34)48(43)45(50)31-24-40(52-3)44(54-5)41(25-31)53-4/h7-20,23-25,30,43,49H,6,21-22,26H2,1-5H3
InChIKey
ZOFXCIBNFYUHKT-UHFFFAOYSA-N
Synonyms

(11(4((4chlorobenzyl)oxy)3ethoxyphenyl)1hydroxy3(4methoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)(345trimethoxyphenyl)methanone
CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1cc(OC)c(c(c1)OC)OC)cccc2)c1ccc(cc1)OC
MFCD03033630
STK052769
ZINC000150406113
ZINC000150406120

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Available files

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