Vitas-M small molecule compound

azepan-1-yl[4-(2,4-dichlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]methanone

Catalog ID
STK549816
SMILES Clc1ccc(c(c1)Cl)C1Nc2ccc(cc2C2C1CC=C2)C(=O)N1CCCCCC1

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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 C25H26Cl2N2O MW 441.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26Cl2N2O/c26-17-9-10-20(22(27)15-17)24-19-7-5-6-18(19)21-14-16(8-11-23(21)28-24)25(30)29-12-3-1-2-4-13-29/h5-6,8-11,14-15,18-19,24,28H,1-4,7,12-13H2
InChIKey
WVDIMIVWIGYONS-UHFFFAOYSA-N
Synonyms
1024572-10-8
1024572108
azepan1yl(4(24dichlorophenyl)3a459btetrahydro3Hcyclopenta(c)quinolin8yl)methanone
C1CCCN(CC1)C(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=C(C=C(C=C5)Cl)Cl
InChI=1SC25H26Cl2N2Oc261791020(22(27)1517)241975618(19)211416(81123(21)2824)25(30)291231241329h56811141518192428H1471213H2
MFCD03191350
ZINC000001796016
ZINC000102710353

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Available files

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