Vitas-M small molecule compound

1-[1-(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]propan-1-one

Catalog ID
STL005524
SMILES CCC(=O)c1c(c2ccc(cc2)OC)c2c3n1cc(n3CCCC2)c1ccc(cc1)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 C27H28N2O2 MW 412.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O2/c1-4-24(30)26-25(20-12-14-21(31-3)15-13-20)22-7-5-6-16-28-23(17-29(26)27(22)28)19-10-8-18(2)9-11-19/h8-15,17H,4-7,16H2,1-3H3
InChIKey
ACJQRVJLFUOATF-UHFFFAOYSA-N
Synonyms
488716-84-3
1(1(4methoxyphenyl)4(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)propan1one
1(1(4methoxyphenyl)4(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)propan1one
488716843
CCC(=O)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC=C(C=C4)C)C5=CC=C(C=C5)OC
InChI=1SC27H28N2O2c1424(30)2625(20121421(313)151320)22756162823(1729(26)27(22)28)1910818(2)91119h81517H4716H213H3
MFCD03291071
ZINC000002413795
ZINC02413795
ZINC2413795

Check stock

See real-time availability and sample size for STL005524 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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