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methyl 2-[(4aR,4bS,7aR,8S)-8-[(3,4-dimethoxyphenyl)carbonyl]-5,7-dioxo-4b,5,7a,8-tetrahydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazin-6(7H)-yl]benzoate

Catalog ID
STK555353
SMILES COC(=O)c1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=CC=N1)C(=O)c1ccc(c(c1)OC)OC

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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 C26H23N3O7 MW 489.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O7/c1-34-18-11-10-14(13-19(18)35-2)23(30)22-21-20(17-9-6-12-27-29(17)22)24(31)28(25(21)32)16-8-5-4-7-15(16)26(33)36-3/h4-13,17,20-22H,1-3H3/t17-,20-,21-,22+/m1/s1
InChIKey
DFOCVBLERFIDIK-CIQXWFTPSA-N
Synonyms
1014100-73-2
1014100732
COC(=O)c1ccccc1N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1(C@@H)2C=CC=N1)C(=O)c1ccc(c(c1)OC)OC
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2N=CC=C4)C(=O)N(C3=O)C5=CC=CC=C5C(=O)OC)OC
InChI=1SC26H23N3O7c13418111014(1319(18)352)23(30)222120(1796122729(17)22)24(31)28(25(21)32)16854715(16)26(33)363h413172022H13H3t17202122+m1s1
methyl2((3aR4S9aR9bS)4(34dimethoxybenzoyl)13dioxo3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazin2yl)benzoate
methyl2((4aR4bS7aR8S)8((34dimethoxyphenyl)carbonyl)57dioxo4b57a8tetrahydro4aHpyrrolo(3434)pyrrolo(12b)pyridazin6(7H)yl)benzoate
methyl2((4aR4bS7aR8S)8(34dimethoxybenzoyl)57dioxo4b57a8tetrahydro4aHpyrrolo(3434)pyrrolo(12b)pyridazin6(7H)yl)benzoate
MFCD18242859
ZINC000008742518
ZINC08742518
ZINC8742518

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Available files

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