About 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione (PubChem CID 165102777) has the molecular formula C132H140Cl2F2N26O23
and a molecular weight of 2567.63 g/mol. Its IUPAC name is 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione.
Frequently Asked Questions
What is the IUPAC name of 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
The IUPAC name of 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione (CID 165102777) is 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione.
What is the SMILES notation for 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
The canonical SMILES for 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione is C=C1CCC(N2Cc3c(/N=N/c4cc(OC)c(OCCCNC5(C)CCN(c6cnc(-c7cccc(Cl)c7Cl)c(N)n6)CC5)c(OC)c4)cccc3C2=O)C(=O)N1.COc1cc2ncnc(Nc3ccc(F)c(C)c3)c2cc1OCCCN1CCN(C(=O)COc2c(OC)cc(/N=N/c3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)cc2OC)CC1.COc1cc2ncnc(Nc3ccc(F)c(C)c3)c2cc1OCCCNCCCC(=O)COc1c(OC)cc(/N=N/c2cccc3c2CN(C2CCC(=O)NC2=O)C3=O)cc1OC.
What is the InChIKey of 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
The InChIKey is YPRSMMITUZXDPA-ATEPKGDSSA-N. The full InChI is InChI=1S/C46H48FN9O9.C45H47FN8O9.C41H45Cl2N9O5/c1-27-19-28(9-10-33(27)47)50-44-31-22-38(37(61-2)23-35(31)48-26-49-44)64-18-6-13-54-14-16-55(17-15-54)42(58)25-65-43-39(62-3)20-29(21-40(43)63-4)52-53-34-8-5-7-30-32(34)24-56(46(30)60)36-11-12-41(57)51-45(36)59;1-26-18-27(11-12-33(26)46)50-43-31-21-38(37(59-2)22-35(31)48-25-49-43)62-17-7-16-47-15-6-8-29(55)24-63-42-39(60-3)19-28(20-40(42)61-4)52-53-34-10-5-9-30-32(34)23-54(45(30)58)36-13-14-41(56)51-44(36)57;1-24-12-13-31(39(53)47-24)52-23-28-26(40(52)54)8-6-11-30(28)50-49-25-20-32(55-3)37(33(21-25)56-4)57-19-7-16-46-41(2)14-17-51(18-15-41)34-22-45-36(38(44)48-34)27-9-5-10-29(42)35(27)43/h5,7-10,19-23,26,36H,6,11-18,24-25H2,1-4H3,(H,48,49,50)(H,51,57,59);5,9-12,18-22,25,36,47H,6-8,13-17,23-24H2,1-4H3,(H,48,49,50)(H,51,56,57);5-6,8-11,20-22,31,46H,1,7,12-19,23H2,2-4H3,(H2,44,48)(H,47,53)/b2*53-52+;50-49+.
What are the key properties of 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione has a molecular weight of 2567.63 g/mol, XLogP of 20.46, 49 rotatable bonds, 8 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-[3-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]propoxy]-3,5-dimethoxyphenyl]diazenyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-3H-isoindol-1-one;3-[7-[[4-[5-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropylamino]-2-oxopentoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[7-[[4-[2-[4-[3-[4-(4-fluoro-3-methylanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-2-oxoethoxy]-3,5-dimethoxyphenyl]diazenyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione is sourced from PubChem (CID 165102777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).