4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid

C89H72B2ClF4IN8O14S6 — CID 158973398

IUPAC4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid
SMILESCOc1c(F)cccc1-c1c[nH]c2nccc(-c3ccsc3)c12.COc1c(F)cccc1-c1cn(S(=O)(=O)c2ccc(C)cc2)c2nccc(-c3ccsc3)c12.COc1c(F)cccc1-c1cn(S(=O)(=O)c2ccc(C)cc2)c2ncccc12.COc1c(F)cccc1B(O)O.Cc1ccc(S(=O)(=O)n2cc(I)c3c(Cl)ccnc32)cc1.OB(O)c1ccsc1
InChIInChI=1S/C25H19FN2O3S2.C21H17FN2O3S.C18H13FN2OS.C14H10ClIN2O2S.C7H8BFO3.C4H5BO2S/c1-16-6-8-18(9-7-16)33(29,30)28-14-21(20-4-3-5-22(26)24(20)31-2)23-19(10-12-27-25(23)28)17-11-13-32-15-17;1-14-8-10-15(11-9-14)28(25,26)24-13-18(17-6-4-12-23-21(17)24)16-5-3-7-19(22)20(16)27-2;1-22-17-13(3-2-4-15(17)19)14-9-21-18-16(14)12(5-7-20-18)11-6-8-23-10-11;1-9-2-4-10(5-3-9)21(19,20)18-8-12(16)13-11(15)6-7-17-14(13)18;1-12-7-5(8(10)11)3-2-4-6(7)9;6-5(7)4-1-2-8-3-4/h3-15H,1-2H3;3-13H,1-2H3;2-10H,1H3,(H,20,21);2-8H,1H3;2-4,10-11H,1H3;1-3,6-7H
InChIKeyJOCAYMJNZVJRKW-UHFFFAOYSA-N
MW1929.97 g/mol
LogP18.41
Rot. Bonds17

About 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid

4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid (PubChem CID 158973398) has the molecular formula C89H72B2ClF4IN8O14S6 and a molecular weight of 1929.97 g/mol. Its IUPAC name is 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid.

Molecular Properties

Compound Name4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid
PubChem CID158973398
Molecular FormulaC89H72B2ClF4IN8O14S6
Molecular Weight1929.97 g/mol
Exact Mass1928.23
IUPAC Name4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid
SMILESCOc1c(F)cccc1-c1c[nH]c2nccc(-c3ccsc3)c12.COc1c(F)cccc1-c1cn(S(=O)(=O)c2ccc(C)cc2)c2nccc(-c3ccsc3)c12.COc1c(F)cccc1-c1cn(S(=O)(=O)c2ccc(C)cc2)c2ncccc12.COc1c(F)cccc1B(O)O.Cc1ccc(S(=O)(=O)n2cc(I)c3c(Cl)ccnc32)cc1.OB(O)c1ccsc1
InChIInChI=1S/C25H19FN2O3S2.C21H17FN2O3S.C18H13FN2OS.C14H10ClIN2O2S.C7H8BFO3.C4H5BO2S/c1-16-6-8-18(9-7-16)33(29,30)28-14-21(20-4-3-5-22(26)24(20)31-2)23-19(10-12-27-25(23)28)17-11-13-32-15-17;1-14-8-10-15(11-9-14)28(25,26)24-13-18(17-6-4-12-23-21(17)24)16-5-3-7-19(22)20(16)27-2;1-22-17-13(3-2-4-15(17)19)14-9-21-18-16(14)12(5-7-20-18)11-6-8-23-10-11;1-9-2-4-10(5-3-9)21(19,20)18-8-12(16)13-11(15)6-7-17-14(13)18;1-12-7-5(8(10)11)3-2-4-6(7)9;6-5(7)4-1-2-8-3-4/h3-15H,1-2H3;3-13H,1-2H3;2-10H,1H3,(H,20,21);2-8H,1H3;2-4,10-11H,1H3;1-3,6-7H
InChIKeyJOCAYMJNZVJRKW-UHFFFAOYSA-N
XLogP18.41
TPSA302.40 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds17
Heavy Atoms125
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001929.97
LogP ≤ 518.41
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid with MolForge

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Related Compounds

3-(4-chloro-2-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2,4-difluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-ethoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-[3-fluoro-2-(trifluoromethyl)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 157404120
3-[4-(azetidin-1-ylsulfonyl)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;N,N-diethyl-2-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzenesulfonamide;N,N-diethyl-3-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzenesulfonamide;N,N-dimethyl-2-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzenesulfonamide;3-(3-pyrrolidin-1-ylsulfonylphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-pyrrolidin-1-ylsulfonylphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-3-[2-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 157451413
3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;4-chloro-3-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2,4-difluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine;[2-(3-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]methanol;4-[3-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-pyridinyl]morpholine
CID 157995194
4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;4-chloro-1-(4-methylphenyl)sulfonyl-3-[2-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine;1-(4-methylphenyl)sulfonyl-4-thiophen-3-yl-3-[2-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid;4-thiophen-3-yl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine;[2-(trifluoromethyl)phenyl]boronic acid
CID 158410697
CID 158905441
CID 158905441
4-Chloro-1-(4-methylphenyl)sulfonyl-3-[3-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine;1-(4-methylphenyl)sulfonyl-4-thiophen-3-yl-3-[3-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid
CID 159184956
3-[4-(azetidin-1-ylsulfonyl)phenyl]-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;N,N-diethyl-2-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzenesulfonamide;N,N-diethyl-3-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzenesulfonamide;N,N-dimethyl-2-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzenesulfonamide;N,N-dimethyl-4-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzenesulfonamide;3-(3-pyrrolidin-1-ylsulfonylphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-pyrrolidin-1-ylsulfonylphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-3-[2-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 159886413
3-(2-chloro-3-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2,4-difluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-ethoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 160218046
CID 160455661
CID 160455661
CID 160873508
CID 160873508
3-(2-chloro-3-fluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;4-chloro-3-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2,4-difluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(4-fluoro-2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-fluorophenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-(5-methylthiophen-2-yl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxy-3-pyridinyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-(5-methylthiophen-2-yl)-3-[2-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine;[2-(3-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]methanol;4-[3-(4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-pyridinyl]morpholine
CID 161382041
3-(2-chloro-3-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-chloro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-chloro-3-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2,4-difluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-ethoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(2-fluorophenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-(2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;4-thiophen-3-yl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 161394803

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid?
The IUPAC name of 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid (CID 158973398) is 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid.
What is the SMILES notation for 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid?
The canonical SMILES for 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid is COc1c(F)cccc1-c1c[nH]c2nccc(-c3ccsc3)c12.COc1c(F)cccc1-c1cn(S(=O)(=O)c2ccc(C)cc2)c2nccc(-c3ccsc3)c12.COc1c(F)cccc1-c1cn(S(=O)(=O)c2ccc(C)cc2)c2ncccc12.COc1c(F)cccc1B(O)O.Cc1ccc(S(=O)(=O)n2cc(I)c3c(Cl)ccnc32)cc1.OB(O)c1ccsc1.
What is the InChIKey of 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid?
The InChIKey is JOCAYMJNZVJRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN2O3S2.C21H17FN2O3S.C18H13FN2OS.C14H10ClIN2O2S.C7H8BFO3.C4H5BO2S/c1-16-6-8-18(9-7-16)33(29,30)28-14-21(20-4-3-5-22(26)24(20)31-2)23-19(10-12-27-25(23)28)17-11-13-32-15-17;1-14-8-10-15(11-9-14)28(25,26)24-13-18(17-6-4-12-23-21(17)24)16-5-3-7-19(22)20(16)27-2;1-22-17-13(3-2-4-15(17)19)14-9-21-18-16(14)12(5-7-20-18)11-6-8-23-10-11;1-9-2-4-10(5-3-9)21(19,20)18-8-12(16)13-11(15)6-7-17-14(13)18;1-12-7-5(8(10)11)3-2-4-6(7)9;6-5(7)4-1-2-8-3-4/h3-15H,1-2H3;3-13H,1-2H3;2-10H,1H3,(H,20,21);2-8H,1H3;2-4,10-11H,1H3;1-3,6-7H.
What are the key properties of 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid?
4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid has a molecular weight of 1929.97 g/mol, XLogP of 18.41, 17 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;(3-fluoro-2-methoxyphenyl)boronic acid;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-4-thiophen-3-ylpyrrolo[2,3-b]pyridine;3-(3-fluoro-2-methoxyphenyl)-4-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine;thiophen-3-ylboronic acid is sourced from PubChem (CID 158973398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).