Vitas-M small molecule compound
11-(3,4-dimethoxyphenyl)-3-(furan-2-yl)-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK868345
SMILES COc1ccc(cc1OC)C1C2=C(CC(CC2=O)c2ccco2)Nc2c(N1C(=O)C(F)(F)F)cccc2
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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 C27H23F3N2O5 MW 512.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23F3N2O5/c1-35-22-10-9-15(14-23(22)36-2)25-24-18(12-16(13-20(24)33)21-8-5-11-37-21)31-17-6-3-4-7-19(17)32(25)26(34)27(28,29)30/h3-11,14,16,25,31H,12-13H2,1-2H3InChIKey
AKWOXFZBZVQYNZ-UHFFFAOYSA-NSynonyms
332861-38-811(34dimethoxyphenyl)3(furan2yl)10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(34dimethoxyphenyl)3(furan2yl)10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
332861388
6(34dimethoxyphenyl)9(furan2yl)5(222trifluoroacetyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CO4)NC5=CC=CC=C5N2C(=O)C(F)(F)F)OC
InChI=1SC27H23F3N2O5c1352210915(1423(22)362)252418(1216(1320(24)33)2185113721)3117634719(17)32(25)26(34)27(2829)30h31114162531H1213H212H3
MFCD01943675
ZINC000000867316
ZINC000009185699
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