Vitas-M small molecule compound

3-(4-tert-butylphenyl)-11-(3,5-di-tert-butyl-4-hydroxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK261671
SMILES CC(C(=O)N1C(c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)C2=C(Nc3c1cccc3)CC(CC2=O)c1ccc(cc1)C(C)(C)C)C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C41H52N2O3 MW 620.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H52N2O3/c1-24(2)38(46)43-33-15-13-12-14-31(33)42-32-22-26(25-16-18-28(19-17-25)39(3,4)5)23-34(44)35(32)36(43)27-20-29(40(6,7)8)37(45)30(21-27)41(9,10)11/h12-21,24,26,36,42,45H,22-23H2,1-11H3
InChIKey
RKNZGXAWAASLPJ-UHFFFAOYSA-N
Synonyms

11(35BIS(TERTBUTYL)4HYDROXYPHENYL)3(4(TERTBUTYL)PHENYL)10(2METHYLPROPANOYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
3(4tertbutylphenyl)11(35ditertbutyl4hydroxyphenyl)10(2methylpropanoyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4tertbutylphenyl)6(35ditertbutyl4hydroxyphenyl)5(2methylpropanoyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(C)C(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C41)C5=CC(=C(C(=C5)C(C)(C)C)O)C(C)(C)C
InChI=1SC41H52N2O3c124(2)38(46)43331513121431(33)42322226(25161828(191725)39(34)5)2334(44)35(32)36(43)272029(40(67)8)37(45)30(2127)41(910)11h12212426364245H2223H2111H3
MFCD03946440
ZINC000005944521
ZINC000005944526

Check stock

See real-time availability and sample size for STK261671 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.