Vitas-M small molecule compound

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

Catalog ID
STK007420
SMILES CCC(=O)N1C(c2cc(OC)c(c(c2)OC)OC)C2=C(Nc3c1cccc3)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 C27H32N2O5 MW 464.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O5/c1-7-23(31)29-19-11-9-8-10-17(19)28-18-14-27(2,3)15-20(30)24(18)25(29)16-12-21(32-4)26(34-6)22(13-16)33-5/h8-13,25,28H,7,14-15H2,1-6H3
InChIKey
GYIBCSJATVPADK-UHFFFAOYSA-N
Synonyms
312621-48-0
312621480
33dimethyl10propanoyl11(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl10propionyl11(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
99dimethyl5propanoyl6(345trimethoxyphenyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC(=C(C(=C4)OC)OC)OC
CCC(=O)N1C(c2cc(OC)c(c(c2)OC)OC)C2=C(Nc3c1cccc3)CC(CC2=O)(C)C
InChI=1SC27H32N2O5c1723(31)291911981017(19)28181427(23)1520(30)24(18)25(29)161221(324)26(346)22(1316)335h8132528H71415H216H3
MFCD01654966
STK007420
ZINC000008994407
ZINC000008994408

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Available files

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