Vitas-M small molecule compound

1-[4-(4-fluorophenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]ethanone

Catalog ID
STL003574
SMILES Fc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)C)c1ccccc1

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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 C24H21FN2O MW 372.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FN2O/c1-16(28)23-22(18-7-3-2-4-8-18)20-9-5-6-14-26-21(15-27(23)24(20)26)17-10-12-19(25)13-11-17/h2-4,7-8,10-13,15H,5-6,9,14H2,1H3
InChIKey
FPDKRJJZKBRCTP-UHFFFAOYSA-N
Synonyms
844645-57-4
1(4(4fluorophenyl)1phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)ethanone
844645574
CC(=O)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC=C(C=C4)F)C5=CC=CC=C5
InChI=1SC24H21FN2Oc116(28)2322(187324818)20956142621(1527(23)24(20)26)17101219(25)131117h2478101315H56914H21H3
MFCD04158071
ZINC000005149555
ZINC05149555
ZINC5149555

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Available files

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