About 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione (PubChem CID 157474399) has the molecular formula C173H153Cl7F2N36O24
and a molecular weight of 3406.52 g/mol. Its IUPAC name is 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione.
Frequently Asked Questions
What is the IUPAC name of 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?
The IUPAC name of 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione (CID 157474399) is 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione.
What is the SMILES notation for 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?
The canonical SMILES for 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione is COc1ccccc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(Cl)ccc31)N(c1cc(C)cn(C)c1=O)C2=O.COc1ncc(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(Cl)ccc42)N(c2cc(C)cc(F)c2)C3=O)c(OC)n1.COc1ncc(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(Cl)ccc42)N(c2cc(C)ccc2F)C3=O)c(OC)n1.COc1ncc(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(Cl)ccc42)N(c2cc(C)cnc2C)C3=O)c(OC)n1.COc1ncc(-c2nc3c(n2C2CCC2)C2(C(=O)Nc4cc(Cl)ccc42)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1.COc1ncc(-c2nc3c(n2C2CCCC2)C2(C(=O)Nc4cc(Cl)ccc42)N(c2cc(C)ccc2C)C3=O)c(OC)n1.
What is the InChIKey of 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?
The InChIKey is BVKLWMQDNGWPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H29ClN6O4.C29H24Cl2N6O4.C29H26ClN5O4.2C28H24ClFN6O4.C28H26ClN7O4/c1-16-9-10-17(2)23(13-16)38-28(39)24-25(31(38)21-12-11-18(32)14-22(21)34-29(31)40)37(19-7-5-6-8-19)26(35-24)20-15-33-30(42-4)36-27(20)41-3;1-14-7-8-16(31)12-21(14)37-26(38)22-23(29(37)19-10-9-15(30)11-20(19)33-27(29)39)36(17-5-4-6-17)24(34-22)18-13-32-28(41-3)35-25(18)40-2;1-15(2)34-24-23(32-25(34)18-8-6-7-9-22(18)39-5)27(37)35(21-12-16(3)14-33(4)26(21)36)29(24)19-11-10-17(30)13-20(19)31-28(29)38;1-13(2)35-22-21(33-23(35)16-12-31-27(40-5)34-24(16)39-4)25(37)36(20-10-14(3)6-9-18(20)30)28(22)17-8-7-15(29)11-19(17)32-26(28)38;1-13(2)35-22-21(33-23(35)18-12-31-27(40-5)34-24(18)39-4)25(37)36(17-9-14(3)8-16(30)11-17)28(22)19-7-6-15(29)10-20(19)32-26(28)38;1-13(2)35-22-21(33-23(35)17-12-31-27(40-6)34-24(17)39-5)25(37)36(20-9-14(3)11-30-15(20)4)28(22)18-8-7-16(29)10-19(18)32-26(28)38/h9-15,19H,5-8H2,1-4H3,(H,34,40);7-13,17H,4-6H2,1-3H3,(H,33,39);6-15H,1-5H3,(H,31,38);2*6-13H,1-5H3,(H,32,38);7-13H,1-6H3,(H,32,38).
What are the key properties of 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?
6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione has a molecular weight of 3406.52 g/mol, XLogP of 30.06, 29 rotatable bonds, 6 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5'-(5-chloro-2-methylphenyl)-3'-cyclobutyl-2'-(2,4-dimethoxypyrimidin-5-yl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-3'-cyclopentyl-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethylphenyl)spiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2,5-dimethyl-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(2-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-2'-(2,4-dimethoxypyrimidin-5-yl)-5'-(3-fluoro-5-methylphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;6-chloro-5'-(1,5-dimethyl-2-oxo-3-pyridinyl)-2'-(2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione is sourced from PubChem (CID 157474399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).