Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-8-(2,2-dimethylpropanoyl)-10-(2-methyl-4-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Catalog ID
STK557029
SMILES Cc1cc(ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=N1)C(=O)C(C)(C)C)[N+](=O)[O-]
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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 C25H24N4O5 MW 460.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O5/c1-13-11-15(29(33)34)9-10-17(13)27-23(31)18-19(24(27)32)21(22(30)25(2,3)4)28-20(18)16-8-6-5-7-14(16)12-26-28/h5-12,18-21H,1-4H3/t18-,19+,20+,21-/m0/s1InChIKey
UHBWMFJLDKFMTC-BQJUDKOJSA-NSynonyms
1013792-80-7(8S8aR11aS11bS)10(2methyl4nitrophenyl)8pivaloyl11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8S8aR11aS11bS)8(22dimethylpropanoyl)10(2methyl4nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
1013792807
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=N4)C(=O)C(C)(C)C
Cc1cc(ccc1N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1(C@@H)2c2ccccc2C=N1)C(=O)C(C)(C)C)(N+)(=O)(O)
InChI=1SC25H24N4O5c1131115(29(33)34)91017(13)2723(31)1819(24(27)32)21(22(30)25(23)4)2820(18)16865714(16)122628h5121821H14H3t1819+20+21m0s1
MFCD18242978
ZINC000018098588
ZINC18098588
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.