Vitas-M small molecule compound

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

Catalog ID
STK138699
SMILES CCCCOc1ccc(cc1)C1C2=C(Nc3c(N1C(=O)C(F)(F)F)cccc3)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 C27H29F3N2O3 MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29F3N2O3/c1-4-5-14-35-18-12-10-17(11-13-18)24-23-20(15-26(2,3)16-22(23)33)31-19-8-6-7-9-21(19)32(24)25(34)27(28,29)30/h6-13,24,31H,4-5,14-16H2,1-3H3
InChIKey
HGTZGUAMVXEBHW-UHFFFAOYSA-N
Synonyms
352703-60-7
11(4butoxyphenyl)33dimethyl10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4butoxyphenyl)33dimethyl10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
352703607
6(4butoxyphenyl)99dimethyl5(222trifluoroacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)C(F)(F)F
InChI=1SC27H29F3N2O3c145143518121017(111318)242320(1526(23)1622(23)33)3119867921(19)32(24)25(34)27(2829)30h6132431H451416H213H3
MFCD01648079
ZINC000008432128
ZINC000008432130

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Available files

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