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(2'S,3'R,4R)-2'-(3,4-dimethoxyphenyl)-3'-(2,2-dimethylpropanoyl)-2-phenyl-2',3'-dihydro-10b'H-spiro[1,3-oxazole-4,1'-pyrrolo[2,1-a]phthalazin]-5-one

Catalog ID
STK558202
SMILES COc1ccc(cc1OC)[C@H]1[C@@H](N2C([C@@]31N=C(OC3=O)c1ccccc1)c1ccccc1C=N2)C(=O)C(C)(C)C

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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 C32H31N3O5 MW 537.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O5/c1-31(2,3)28(36)26-25(20-15-16-23(38-4)24(17-20)39-5)32(27-22-14-10-9-13-21(22)18-33-35(26)27)30(37)40-29(34-32)19-11-7-6-8-12-19/h6-18,25-27H,1-5H3/t25-,26+,27?,32+/m0/s1
InChIKey
MOAYBUZKDWDQOI-HECSZSAYSA-N
Synonyms
1164553-68-7
(1R2S3R)2(34dimethoxyphenyl)2phenyl3pivaloyl310bdihydro2H5Hspiro(oxazole41pyrrolo(21a)phthalazin)5one
(2S3R4R)2(34dimethoxyphenyl)3(22dimethylpropanoyl)2phenyl23dihydro10bHspiro(13oxazole41pyrrolo(21a)phthalazin)5one
(2S3R4R)2(34dimethoxyphenyl)3(22dimethylpropanoyl)2phenylspiro(13oxazole41310bdihydro2Hpyrrolo(21a)phthalazine)5one
1164553687
CC(C)(C)C(=O)C1C(C2(C3N1N=CC4=CC=CC=C34)C(=O)OC(=N2)C5=CC=CC=C5)C6=CC(=C(C=C6)OC)OC
COc1ccc(cc1OC)(C@H)1(C@@H)(N2C((C@@)31N=C(OC3=O)c1ccccc1)c1ccccc1C=N2)C(=O)C(C)(C)C
InChI=1SC32H31N3O5c131(23)28(36)2625(20151623(384)24(1720)395)32(2722141091321(22)183335(26)27)30(37)4029(3432)19117681219h6182527H15H3t2526+27?32+m0s1
MFCD18243070
ZINC000008687164
ZINC000008687165

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Available files

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