3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione

C302H291F7N50O42S6 — CID 167668770

IUPAC3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
SMILESCN(C)c1ccc(-c2cc(C(F)(F)F)c(-c3nc4ccc(CCCCOc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)cn2)cn1.CN(C)c1ccc(-c2ccc(-c3cn4cc(OCCOCCN5C(=O)CCC(N6C(=O)c7ccc(O)cc7C6=O)C5=O)ccc4n3)cn2)c(F)n1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCCOCCCOc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4o3)cc2F)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCNC(=O)COc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)c(F)n2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCN5C(=O)CCC(N6Cc7c(N)cccc7C6=O)C5=O)cc4s3)cn2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCN5C(=O)CCC(N6Cc7cc(O)ccc7C6=O)C5=O)cc4s3)nc2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCOCCNc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)c(F)c2)cn1.COc1cc(-c2ccc(N(C)C)nc2)ncc1-c1nc2ccc(CCCOCCOc3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)cc2s1
InChIInChI=1S/C40H41FN6O5S.C40H40FN5O6.C38H38N6O6S.C37H33F3N6O4S.C37H34FN7O5S.C37H37N7O4S.C37H36N6O5S.C36H32FN7O7/c1-46(2)36-13-7-27(23-43-36)26-6-9-31(32(41)22-26)39-44-33-11-5-25(20-35(33)53-39)4-3-16-51-18-19-52-17-15-42-29-8-10-30-28(21-29)24-47(40(30)50)34-12-14-37(48)45-38(34)49;1-45(2)36-15-9-27(23-42-36)30-11-8-26(22-32(30)41)39-43-33-13-7-25(20-35(33)52-39)6-3-4-17-50-18-5-19-51-29-10-12-31-28(21-29)24-46(40(31)49)34-14-16-37(47)44-38(34)48;1-43(2)34-12-7-24(20-40-34)30-19-32(48-3)28(21-39-30)37-41-29-10-6-23(17-33(29)51-37)5-4-14-49-15-16-50-26-8-9-27-25(18-26)22-44(38(27)47)31-11-13-35(45)42-36(31)46;1-45(2)32-12-7-22(18-42-32)29-17-27(37(38,39)40)26(19-41-29)35-43-28-10-6-21(15-31(28)51-35)5-3-4-14-50-24-8-9-25-23(16-24)20-46(36(25)49)30-11-13-33(47)44-34(30)48;1-44(2)31-13-6-22(18-40-31)27-11-9-26(34(38)41-27)36-42-28-10-5-21(16-30(28)51-36)4-3-15-39-33(47)20-50-24-7-8-25-23(17-24)19-45(37(25)49)29-12-14-32(46)43-35(29)48;1-42(2)33-14-10-24(20-40-33)29-12-9-25(21-39-29)35-41-30-11-8-23(19-32(30)49-35)5-4-17-48-18-16-43-34(45)15-13-31(37(43)47)44-22-27-26(36(44)46)6-3-7-28(27)38;1-41(2)33-13-7-25(21-39-33)24-6-11-30(38-20-24)35-40-29-10-5-23(18-32(29)49-35)4-3-16-48-17-15-42-34(45)14-12-31(37(42)47)43-22-26-19-27(44)8-9-28(26)36(43)46;1-41(2)30-11-7-25(33(37)40-30)27-8-3-21(18-38-27)28-20-42-19-23(5-10-31(42)39-28)51-16-15-50-14-13-43-32(46)12-9-29(36(43)49)44-34(47)24-6-4-22(45)17-26(24)35(44)48/h5-11,13,20-23,34,42H,3-4,12,14-19,24H2,1-2H3,(H,45,48,49);7-13,15,20-23,34H,3-6,14,16-19,24H2,1-2H3,(H,44,47,48);6-10,12,17-21,31H,4-5,11,13-16,22H2,1-3H3,(H,42,45,46);6-10,12,15-19,30H,3-5,11,13-14,20H2,1-2H3,(H,44,47,48);5-11,13,16-18,29H,3-4,12,14-15,19-20H2,1-2H3,(H,39,47)(H,43,46,48);3,6-12,14,19-21,31H,4-5,13,15-18,22,38H2,1-2H3;5-11,13,18-21,31,44H,3-4,12,14-17,22H2,1-2H3;3-8,10-11,17-20,29,45H,9,12-16H2,1-2H3
InChIKeyTUFMTAAUYZENCU-UHFFFAOYSA-N
MW5618.35 g/mol
LogP42.95
Rot. Bonds96

About 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione

3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione (PubChem CID 167668770) has the molecular formula C302H291F7N50O42S6 and a molecular weight of 5618.35 g/mol. Its IUPAC name is 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione.

Molecular Properties

Compound Name3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
PubChem CID167668770
Molecular FormulaC302H291F7N50O42S6
Molecular Weight5618.35 g/mol
Exact Mass5614.04
IUPAC Name3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
SMILESCN(C)c1ccc(-c2cc(C(F)(F)F)c(-c3nc4ccc(CCCCOc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)cn2)cn1.CN(C)c1ccc(-c2ccc(-c3cn4cc(OCCOCCN5C(=O)CCC(N6C(=O)c7ccc(O)cc7C6=O)C5=O)ccc4n3)cn2)c(F)n1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCCOCCCOc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4o3)cc2F)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCNC(=O)COc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)c(F)n2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCN5C(=O)CCC(N6Cc7c(N)cccc7C6=O)C5=O)cc4s3)cn2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCN5C(=O)CCC(N6Cc7cc(O)ccc7C6=O)C5=O)cc4s3)nc2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCOCCNc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)c(F)c2)cn1.COc1cc(-c2ccc(N(C)C)nc2)ncc1-c1nc2ccc(CCCOCCOc3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)cc2s1
InChIInChI=1S/C40H41FN6O5S.C40H40FN5O6.C38H38N6O6S.C37H33F3N6O4S.C37H34FN7O5S.C37H37N7O4S.C37H36N6O5S.C36H32FN7O7/c1-46(2)36-13-7-27(23-43-36)26-6-9-31(32(41)22-26)39-44-33-11-5-25(20-35(33)53-39)4-3-16-51-18-19-52-17-15-42-29-8-10-30-28(21-29)24-47(40(30)50)34-12-14-37(48)45-38(34)49;1-45(2)36-15-9-27(23-42-36)30-11-8-26(22-32(30)41)39-43-33-13-7-25(20-35(33)52-39)6-3-4-17-50-18-5-19-51-29-10-12-31-28(21-29)24-46(40(31)49)34-14-16-37(47)44-38(34)48;1-43(2)34-12-7-24(20-40-34)30-19-32(48-3)28(21-39-30)37-41-29-10-6-23(17-33(29)51-37)5-4-14-49-15-16-50-26-8-9-27-25(18-26)22-44(38(27)47)31-11-13-35(45)42-36(31)46;1-45(2)32-12-7-22(18-42-32)29-17-27(37(38,39)40)26(19-41-29)35-43-28-10-6-21(15-31(28)51-35)5-3-4-14-50-24-8-9-25-23(16-24)20-46(36(25)49)30-11-13-33(47)44-34(30)48;1-44(2)31-13-6-22(18-40-31)27-11-9-26(34(38)41-27)36-42-28-10-5-21(16-30(28)51-36)4-3-15-39-33(47)20-50-24-7-8-25-23(17-24)19-45(37(25)49)29-12-14-32(46)43-35(29)48;1-42(2)33-14-10-24(20-40-33)29-12-9-25(21-39-29)35-41-30-11-8-23(19-32(30)49-35)5-4-17-48-18-16-43-34(45)15-13-31(37(43)47)44-22-27-26(36(44)46)6-3-7-28(27)38;1-41(2)33-13-7-25(21-39-33)24-6-11-30(38-20-24)35-40-29-10-5-23(18-32(29)49-35)4-3-16-48-17-15-42-34(45)14-12-31(37(42)47)43-22-26-19-27(44)8-9-28(26)36(43)46;1-41(2)30-11-7-25(33(37)40-30)27-8-3-21(18-38-27)28-20-42-19-23(5-10-31(42)39-28)51-16-15-50-14-13-43-32(46)12-9-29(36(43)49)44-34(47)24-6-4-22(45)17-26(24)35(44)48/h5-11,13,20-23,34,42H,3-4,12,14-19,24H2,1-2H3,(H,45,48,49);7-13,15,20-23,34H,3-6,14,16-19,24H2,1-2H3,(H,44,47,48);6-10,12,17-21,31H,4-5,11,13-16,22H2,1-3H3,(H,42,45,46);6-10,12,15-19,30H,3-5,11,13-14,20H2,1-2H3,(H,44,47,48);5-11,13,16-18,29H,3-4,12,14-15,19-20H2,1-2H3,(H,39,47)(H,43,46,48);3,6-12,14,19-21,31H,4-5,13,15-18,22,38H2,1-2H3;5-11,13,18-21,31,44H,3-4,12,14-17,22H2,1-2H3;3-8,10-11,17-20,29,45H,9,12-16H2,1-2H3
InChIKeyTUFMTAAUYZENCU-UHFFFAOYSA-N
XLogP42.95
TPSA1077.19 Ų
H-Bond Donors10
H-Bond Acceptors81
Rotatable Bonds96
Heavy Atoms407
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005618.35
LogP ≤ 542.95
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1081

Analyze 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
The IUPAC name of 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione (CID 167668770) is 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione.
What is the SMILES notation for 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
The canonical SMILES for 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione is CN(C)c1ccc(-c2cc(C(F)(F)F)c(-c3nc4ccc(CCCCOc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)cn2)cn1.CN(C)c1ccc(-c2ccc(-c3cn4cc(OCCOCCN5C(=O)CCC(N6C(=O)c7ccc(O)cc7C6=O)C5=O)ccc4n3)cn2)c(F)n1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCCOCCCOc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4o3)cc2F)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCNC(=O)COc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)c(F)n2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCN5C(=O)CCC(N6Cc7c(N)cccc7C6=O)C5=O)cc4s3)cn2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCN5C(=O)CCC(N6Cc7cc(O)ccc7C6=O)C5=O)cc4s3)nc2)cn1.CN(C)c1ccc(-c2ccc(-c3nc4ccc(CCCOCCOCCNc5ccc6c(c5)CN(C5CCC(=O)NC5=O)C6=O)cc4s3)c(F)c2)cn1.COc1cc(-c2ccc(N(C)C)nc2)ncc1-c1nc2ccc(CCCOCCOc3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)cc2s1.
What is the InChIKey of 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
The InChIKey is TUFMTAAUYZENCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H41FN6O5S.C40H40FN5O6.C38H38N6O6S.C37H33F3N6O4S.C37H34FN7O5S.C37H37N7O4S.C37H36N6O5S.C36H32FN7O7/c1-46(2)36-13-7-27(23-43-36)26-6-9-31(32(41)22-26)39-44-33-11-5-25(20-35(33)53-39)4-3-16-51-18-19-52-17-15-42-29-8-10-30-28(21-29)24-47(40(30)50)34-12-14-37(48)45-38(34)49;1-45(2)36-15-9-27(23-42-36)30-11-8-26(22-32(30)41)39-43-33-13-7-25(20-35(33)52-39)6-3-4-17-50-18-5-19-51-29-10-12-31-28(21-29)24-46(40(31)49)34-14-16-37(47)44-38(34)48;1-43(2)34-12-7-24(20-40-34)30-19-32(48-3)28(21-39-30)37-41-29-10-6-23(17-33(29)51-37)5-4-14-49-15-16-50-26-8-9-27-25(18-26)22-44(38(27)47)31-11-13-35(45)42-36(31)46;1-45(2)32-12-7-22(18-42-32)29-17-27(37(38,39)40)26(19-41-29)35-43-28-10-6-21(15-31(28)51-35)5-3-4-14-50-24-8-9-25-23(16-24)20-46(36(25)49)30-11-13-33(47)44-34(30)48;1-44(2)31-13-6-22(18-40-31)27-11-9-26(34(38)41-27)36-42-28-10-5-21(16-30(28)51-36)4-3-15-39-33(47)20-50-24-7-8-25-23(17-24)19-45(37(25)49)29-12-14-32(46)43-35(29)48;1-42(2)33-14-10-24(20-40-33)29-12-9-25(21-39-29)35-41-30-11-8-23(19-32(30)49-35)5-4-17-48-18-16-43-34(45)15-13-31(37(43)47)44-22-27-26(36(44)46)6-3-7-28(27)38;1-41(2)33-13-7-25(21-39-33)24-6-11-30(38-20-24)35-40-29-10-5-23(18-32(29)49-35)4-3-16-48-17-15-42-34(45)14-12-31(37(42)47)43-22-26-19-27(44)8-9-28(26)36(43)46;1-41(2)30-11-7-25(33(37)40-30)27-8-3-21(18-38-27)28-20-42-19-23(5-10-31(42)39-28)51-16-15-50-14-13-43-32(46)12-9-29(36(43)49)44-34(47)24-6-4-22(45)17-26(24)35(44)48/h5-11,13,20-23,34,42H,3-4,12,14-19,24H2,1-2H3,(H,45,48,49);7-13,15,20-23,34H,3-6,14,16-19,24H2,1-2H3,(H,44,47,48);6-10,12,17-21,31H,4-5,11,13-16,22H2,1-3H3,(H,42,45,46);6-10,12,15-19,30H,3-5,11,13-14,20H2,1-2H3,(H,44,47,48);5-11,13,16-18,29H,3-4,12,14-15,19-20H2,1-2H3,(H,39,47)(H,43,46,48);3,6-12,14,19-21,31H,4-5,13,15-18,22,38H2,1-2H3;5-11,13,18-21,31,44H,3-4,12,14-17,22H2,1-2H3;3-8,10-11,17-20,29,45H,9,12-16H2,1-2H3.
What are the key properties of 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione?
3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione has a molecular weight of 5618.35 g/mol, XLogP of 42.95, 96 rotatable bonds, 10 hydrogen bond donors, and 81 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-amino-3-oxo-1H-isoindol-2-yl)-1-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]piperidine-2,6-dione;2-[1-[2-[2-[2-[6-[6-(dimethylamino)-2-fluoro-3-pyridinyl]-3-pyridinyl]imidazo[1,2-a]pyridin-6-yl]oxyethoxy]ethyl]-2,6-dioxopiperidin-3-yl]-5-hydroxyisoindole-1,3-dione;3-[6-[2-[2-[3-[2-[4-[6-(dimethylamino)-3-pyridinyl]-2-fluorophenyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]ethylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;3-[6-[3-[4-[2-[4-[6-(dimethylamino)-3-pyridinyl]-3-fluorophenyl]-1,3-benzoxazol-6-yl]butoxy]propoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;N-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-2-fluoro-3-pyridinyl]-1,3-benzothiazol-6-yl]propyl]-2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]acetamide;3-[6-[2-[3-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-methoxy-3-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;1-[2-[3-[2-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-1,3-benzothiazol-6-yl]propoxy]ethyl]-3-(6-hydroxy-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[6-[4-[2-[6-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]butoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione is sourced from PubChem (CID 167668770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).