Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-6-(2-chloro-5-nitrophenyl)-8-(phenylcarbonyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK549788
SMILES O=C([C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1Cl)[N+](=O)[O-])c1ccccc1
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 C22H15ClN4O5 MW 450.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN4O5/c23-14-9-8-13(27(31)32)11-16(14)25-21(29)17-15-7-4-10-24-26(15)19(18(17)22(25)30)20(28)12-5-2-1-3-6-12/h1-11,15,17-19H/t15-,17-,18-,19+/m1/s1InChIKey
KKMKPPZWRNPUAM-OWYHZJEWSA-NSynonyms
1013748-21-4(3aR4S9aR9bS)4benzoyl2(2chloro5nitrophenyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aR4bS7aR8S)6(2chloro5nitrophenyl)8(phenylcarbonyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4aR4bS7aR8S)8benzoyl6(2chloro5nitrophenyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1013748214
C1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC=C4)C(=O)N(C3=O)C5=C(C=CC(=C5)(N+)(=O)(O))Cl
InChI=1SC22H15ClN4O5c23149813(27(31)32)1116(14)2521(29)171574102426(15)19(18(17)22(25)30)20(28)125213612h111151719Ht15171819+m1s1
MFCD18242492
O=C((C@H)1N2N=CC=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1cc(ccc1Cl)(N+)(=O)(O))c1ccccc1
ZINC000009334724
ZINC09334724
ZINC9334724
Check stock
See real-time availability and sample size for STK549788 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.