Vitas-M small molecule compound

11-(6-nitro-1,3-benzodioxol-5-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK048611
SMILES O=C1CCCC2=C1C(Nc1c(N2)cccc1)c1cc2OCOc2cc1[N+](=O)[O-]

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 C20H17N3O5 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O5/c24-16-7-3-6-14-19(16)20(22-13-5-2-1-4-12(13)21-14)11-8-17-18(28-10-27-17)9-15(11)23(25)26/h1-2,4-5,8-9,20-22H,3,6-7,10H2
InChIKey
SSJRBQPNYMQLJB-UHFFFAOYSA-N
Synonyms

11(6nitro13benzodioxol5yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(6nitro13benzodioxol5yl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1CC2=C(C(NC3=CC=CC=C3N2)C4=CC5=C(C=C4(N+)(=O)(O))OCO5)C(=O)C1
InChI=1SC20H17N3O5c24167361419(16)20(2213521412(13)2114)1181718(28102717)915(11)23(25)26h1245892022H36710H2
MFCD02917525
O=C1CCCC2=C1C(Nc1c(N2)cccc1)c1cc2OCOc2cc1(N+)(=O)(O)
STK048611
ZINC000005104842
ZINC000005104848

Check stock

See real-time availability and sample size for STK048611 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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