Vitas-M small molecule compound

5,7-diphenyl-1,2,3,4,4a,5-hexahydro-13H-benzimidazo[2,1-j]quinoline

Catalog ID
STL321708
SMILES c1ccc(cc1)C1C=C(c2ccccc2)N2C3(C1CCCC3)Nc1c2cccc1

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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 C27H26N2 MW 378.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2/c1-3-11-20(12-4-1)22-19-26(21-13-5-2-6-14-21)29-25-17-8-7-16-24(25)28-27(29)18-10-9-15-23(22)27/h1-8,11-14,16-17,19,22-23,28H,9-10,15,18H2
InChIKey
MJAVVCYAKFNNDX-UHFFFAOYSA-N
Synonyms
1187388-36-8
1187388368
57diphenyl12344a5hexahydro13Hbenzimidazo(21j)quinoline
57diphenyl2344a513hexahydro1Hbenzo(45)imidazo(21j)quinoline
C1CCC23C(C1)C(C=C(N2C4=CC=CC=C4N3)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC27H26N2c131120(1241)221926(21135261421)292517871624(25)2827(29)181091523(22)27h181114161719222328H9101518H2
MFCD01088632
ZINC000002285864
ZINC000013511058

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Available files

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