Vitas-M small molecule compound
(8R,8aS,11aR)-10-(4-methoxyphenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK553236
SMILES COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)OC)cccc3
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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 C28H23N3O5 MW 481.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O5/c1-35-19-11-7-16(8-12-19)26(32)25-23-22(24-21-6-4-3-5-17(21)15-29-31(24)25)27(33)30(28(23)34)18-9-13-20(36-2)14-10-18/h3-15,22-25H,1-2H3/t22-,23+,24?,25-/m1/s1InChIKey
FJMWXYDYEBSDBJ-DVMHTGGUSA-NSynonyms
1014062-77-1(8R8aS11aR)10(4methoxyphenyl)8((4methoxyphenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8R8aS11aR)8(4methoxybenzoyl)10(4methoxyphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1014062771
COC1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=C(C=C6)OC
COc1ccc(cc1)C(=O)(C@@H)1N2N=Cc3c(C2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1)OC)cccc3
InChI=1SC28H23N3O5c1351911716(81219)26(32)252322(2421643517(21)152931(24)25)27(33)30(28(23)34)1891320(362)141018h3152225H12H3t2223+24?25m1s1
MFCD18242704
ZINC000009428605
ZINC000009428606
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.