About 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine
5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine (PubChem CID 160823034) has the molecular formula C153H145BBr6I2N28O17S5Si3
and a molecular weight of 3636.66 g/mol. Its IUPAC name is 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine.
Frequently Asked Questions
What is the IUPAC name of 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine?
The IUPAC name of 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine (CID 160823034) is 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine.
What is the SMILES notation for 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine?
The canonical SMILES for 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine is Brc1cnc2[nH]cc(-c3ccoc3)c2c1.Brc1cnc2[nH]cc(-c3cnco3)c2c1.CN(C)c1ccc(-c2cnc3c(c2)c(B2OC(C)(C)C(C)(C)O2)cn3S(=O)(=O)c2ccccc2)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(Br)cn3COCC[Si](C)(C)C)cc1.CN(C)c1ccc(-c2cnc3c(c2)c(I)cn3S(=O)(=O)c2ccccc2)cn1.C[SiH](C)c1[nH]c2ncc(Br)cc2c1-c1ccoc1.C[SiH](C)c1[nH]c2ncc(Br)cc2c1-c1cnn(S(=O)(=O)c2ccccc2)c1.Ic1cn(OOSc2ccccc2)c2ncc(N3CCOCC3)cc12.O=S(=O)(c1ccccc1)n1cc(-c2c[nH]c3ncc(Br)cc23)cn1.
What is the InChIKey of 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine?
The InChIKey is SFUJCJNMZQYNSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30BN3O4S.C21H28BrN3OSi.C20H17IN4O2S.C18H17BrN4O2SSi.C17H16IN3O3S.C16H11BrN4O2S.C13H13BrN2OSi.C11H7BrN2O.C10H6BrN3O/c1-26(2)27(3,4)35-28(34-26)24-18-31(36(32,33)22-10-8-7-9-11-22)25-23(24)16-20(17-29-25)19-12-14-21(15-13-19)30(5)6;1-24(2)18-8-6-16(7-9-18)17-12-19-20(22)14-25(21(19)23-13-17)15-26-10-11-27(3,4)5;1-24(2)19-9-8-14(11-22-19)15-10-17-18(21)13-25(20(17)23-12-15)28(26,27)16-6-4-3-5-7-16;1-27(2)18-16(15-8-13(19)10-20-17(15)22-18)12-9-21-23(11-12)26(24,25)14-6-4-3-5-7-14;18-16-12-21(23-24-25-14-4-2-1-3-5-14)17-15(16)10-13(11-19-17)20-6-8-22-9-7-20;17-12-6-14-15(9-19-16(14)18-8-12)11-7-20-21(10-11)24(22,23)13-4-2-1-3-5-13;1-18(2)13-11(8-3-4-17-7-8)10-5-9(14)6-15-12(10)16-13;12-8-3-9-10(7-1-2-15-6-7)5-14-11(9)13-4-8;11-6-1-7-8(9-4-12-5-15-9)3-14-10(7)13-2-6/h7-18H,1-6H3;6-9,12-14H,10-11,15H2,1-5H3;3-13H,1-2H3;3-11,27H,1-2H3,(H,20,22);1-5,10-12H,6-9H2;1-10H,(H,18,19);3-7,18H,1-2H3,(H,15,16);1-6H,(H,13,14);1-5H,(H,13,14).
What are the key properties of 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine?
5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine has a molecular weight of 3636.66 g/mol, XLogP of 34.09, 32 rotatable bonds, 5 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(benzenesulfonyl)-3-iodopyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine;3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridine;[3-[1-(benzenesulfonyl)pyrazol-4-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;4-[1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridine;[5-bromo-3-(furan-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-dimethylsilane;5-(5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-oxazole;4-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylaniline;4-(3-iodo-1-phenylsulfanylperoxypyrrolo[2,3-b]pyridin-5-yl)morpholine is sourced from PubChem (CID 160823034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).