Vitas-M small molecule compound

pentyl 3-(1-bromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate (non-preferred name)

Catalog ID
STK268687
SMILES CCCCCOC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)C1(Br)c3c(C2c2c1cccc2)cccc3

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 C30H26BrNO4 MW 544.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26BrNO4/c1-2-3-8-16-36-29(35)18-10-9-11-19(17-18)32-27(33)25-24-20-12-4-6-14-22(20)30(31,26(25)28(32)34)23-15-7-5-13-21(23)24/h4-7,9-15,17,24-26H,2-3,8,16H2,1H3
InChIKey
HCQYWMFTMBXVGA-UHFFFAOYSA-N
Synonyms

CCCCCOC(=O)C1=CC(=CC=C1)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)Br
InChI=1SC30H26BrNO4c1238163629(35)181091119(1718)3227(33)25242012461422(20)30(3126(25)28(32)34)2315751321(23)24h47915172426H23816H21H3
MFCD01174906
pentyl3(1bromo1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)benzoate(nonpreferredname)
ZINC000002062336
ZINC000004176194

Check stock

See real-time availability and sample size for STK268687 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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