Vitas-M small molecule compound
(2'R,3'R)-3'-(2,2-dimethylpropanoyl)-2'-(4-methoxyphenyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione
Catalog ID
STK552091
SMILES COc1ccc(cc1)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)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 C31H28N2O4 MW 492.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O4/c1-30(2,3)29(36)25-24(18-13-15-20(37-4)16-14-18)31(27(34)22-11-7-8-12-23(22)28(31)35)26-21-10-6-5-9-19(21)17-32-33(25)26/h5-17,24-26H,1-4H3/t24-,25+,26?/m0/s1InChIKey
PSPGAUOQXLYVQZ-LHJLODMPSA-NSynonyms
1212459-18-1(2R3R)2(4methoxyphenyl)3pivaloyl310bdihydro2Hspiro(indene21pyrrolo(21a)phthalazine)13dione
(2R3R)3(22dimethylpropanoyl)2(4methoxyphenyl)23dihydro10bHspiro(indene21pyrrolo(21a)phthalazine)13dione
(2R3R)3(22dimethylpropanoyl)2(4methoxyphenyl)spiro(310bdihydro2Hpyrrolo(21a)phthalazine12indene)13dione
1212459181
CC(C)(C)C(=O)C1C(C2(C3N1N=CC4=CC=CC=C34)C(=O)C5=CC=CC=C5C2=O)C6=CC=C(C=C6)OC
COc1ccc(cc1)(C@H)1(C@@H)(N2C((C@@)31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)C(=O)C(C)(C)C
COc1ccc(cc1)(C@H)1(C@@H)(N2C(C31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)C(=O)C(C)(C)C
InChI=1SC31H28N2O4c130(23)29(36)2524(18131520(374)161418)31(27(34)2211781223(22)28(31)35)26211065919(21)173233(25)26h5172426H14H3t2425+26?m0s1
ZINC000009461089
ZINC000009461090
Check stock
See real-time availability and sample size for STK552091 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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