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(3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(naphthalen-2-yl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione

Catalog ID
STK547040
SMILES COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)C(=O)c1ccccc1

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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 C35H25BrN2O5 MW 633.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H25BrN2O5/c1-43-28-14-12-23(18-26(28)36)33(40)31-30-29(27-19-24(15-16-37(27)31)32(39)21-8-3-2-4-9-21)34(41)38(35(30)42)25-13-11-20-7-5-6-10-22(20)17-25/h2-19,27,29-31H,1H3/t27-,29-,30-,31+/m1/s1
InChIKey
JFTBUCCUCYHBDF-RJIGRWNCSA-N
Synonyms

(3aR4S9aR9bS)4((3bromo4methoxyphenyl)carbonyl)2(naphthalen2yl)8(phenylcarbonyl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3aR4S9aR9bS)8benzoyl4(3bromo4methoxybenzoyl)2(naphthalen2yl)3a49a9btetrahydro1Hpyrrolo(34a)indolizine13(2H)dione
(3aR4S9aR9bS)8benzoyl4(3bromo4methoxybenzoyl)2naphthalen2yl3a49a9btetrahydropyrrolo(34a)indolizine13dione
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2C=CC(=C4)C(=O)C5=CC=CC=C5)C(=O)N(C3=O)C6=CC7=CC=CC=C7C=C6)Br
COc1ccc(cc1Br)C(=O)(C@H)1N2C=CC(=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc2c(c1)cccc2)C(=O)c1ccccc1
InChI=1SC35H25BrN2O5c14328141223(1826(28)36)33(40)313029(271924(151637(27)31)32(39)218324921)34(41)38(35(30)42)251311207561022(20)1725h219272931H1H3t27293031+m1s1
MFCD18242323
ZINC000150429582
ZINC150429582

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Available files

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