Vitas-M small molecule compound
3-(4-tert-butylphenyl)-10-hexanoyl-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK766515
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccnc1)C(=O)CC(C2)c1ccc(cc1)C(C)(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 C34H39N3O2 MW 521.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39N3O2/c1-5-6-7-14-31(39)37-29-13-9-8-12-27(29)36-28-20-25(23-15-17-26(18-16-23)34(2,3)4)21-30(38)32(28)33(37)24-11-10-19-35-22-24/h8-13,15-19,22,25,33,36H,5-7,14,20-21H2,1-4H3InChIKey
SGFYSGLIADLYHD-UHFFFAOYSA-NSynonyms
3(4tertbutylphenyl)10hexanoyl11(pyridin3yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4tertbutylphenyl)5hexanoyl6pyridin3yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C41)C5=CN=CC=C5
InChI=1SC34H39N3O2c15671431(39)372913981227(29)36282025(23151726(181623)34(23)4)2130(38)32(28)33(37)24111019352224h813151922253336H57142021H214H3
MFCD03036107
ZINC000008846350
ZINC000008846353
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