2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide

C133H128ClF21N28O14S7 — CID 160852938

IUPAC2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide
SMILESCC(C)(C)NS(=O)(=O)c1ccc(-c2c(C(N)=O)c3cc(Cl)cnc3n2C2CCC2)cc1.CC(C)(NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(C(F)(F)F)cnc3n2C2CCC2)nc1)C(F)(F)F.CNc1cnc2c(c1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCC1.CSc1cnc2c(c1)c(C(N)=O)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cc1)n2C1CCC1.N#Cc1c(-c2ccc(S(=O)(=O)NC3(C(F)(F)F)CC3)cc2)n(C2CCC2)c2ncc(C(F)(F)F)cc12.N#Cc1c(-c2ccc(S(=O)(=O)NC3(C(F)(F)F)CC3)cn2)n(C2CCC2)c2ncc(C(F)(F)F)cc12
InChIInChI=1S/C23H18F6N4O2S.C23H28N4O3S2.C22H25ClN4O3S.C22H17F6N5O2S.C22H19F6N5O2S.C21H21F3N6O2S/c24-22(25,26)14-10-17-18(11-30)19(33(15-2-1-3-15)20(17)31-12-14)13-4-6-16(7-5-13)36(34,35)32-21(8-9-21)23(27,28)29;1-23(2,3)26-32(29,30)17-10-8-14(9-11-17)20-19(21(24)28)18-12-16(31-4)13-25-22(18)27(20)15-6-5-7-15;1-22(2,3)26-31(29,30)16-9-7-13(8-10-16)19-18(20(24)28)17-11-14(23)12-25-21(17)27(19)15-5-4-6-15;23-21(24,25)12-8-15-16(9-29)18(33(13-2-1-3-13)19(15)31-10-12)17-5-4-14(11-30-17)36(34,35)32-20(6-7-20)22(26,27)28;1-20(2,22(26,27)28)32-36(34,35)14-6-7-17(30-11-14)18-16(9-29)15-8-12(21(23,24)25)10-31-19(15)33(18)13-4-3-5-13;1-12(21(22,23)24)29-33(31,32)15-6-7-18(27-11-15)19-17(9-25)16-8-13(26-2)10-28-20(16)30(19)14-4-3-5-14/h4-7,10,12,15,32H,1-3,8-9H2;8-13,15,26H,5-7H2,1-4H3,(H2,24,28);7-12,15,26H,4-6H2,1-3H3,(H2,24,28);4-5,8,10-11,13,32H,1-3,6-7H2;6-8,10-11,13,32H,3-5H2,1-2H3;6-8,10-12,14,26,29H,3-5H2,1-2H3/t;;;;;12-/m.....0/s1
InChIKeySJMORIHBVKNZQM-QJNKDRDFSA-N
MW3001.55 g/mol
LogP28.66
Rot. Bonds32

About 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide

2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide (PubChem CID 160852938) has the molecular formula C133H128ClF21N28O14S7 and a molecular weight of 3001.55 g/mol. Its IUPAC name is 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide
PubChem CID160852938
Molecular FormulaC133H128ClF21N28O14S7
Molecular Weight3001.55 g/mol
Exact Mass2998.76
IUPAC Name2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide
SMILESCC(C)(C)NS(=O)(=O)c1ccc(-c2c(C(N)=O)c3cc(Cl)cnc3n2C2CCC2)cc1.CC(C)(NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(C(F)(F)F)cnc3n2C2CCC2)nc1)C(F)(F)F.CNc1cnc2c(c1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCC1.CSc1cnc2c(c1)c(C(N)=O)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cc1)n2C1CCC1.N#Cc1c(-c2ccc(S(=O)(=O)NC3(C(F)(F)F)CC3)cc2)n(C2CCC2)c2ncc(C(F)(F)F)cc12.N#Cc1c(-c2ccc(S(=O)(=O)NC3(C(F)(F)F)CC3)cn2)n(C2CCC2)c2ncc(C(F)(F)F)cc12
InChIInChI=1S/C23H18F6N4O2S.C23H28N4O3S2.C22H25ClN4O3S.C22H17F6N5O2S.C22H19F6N5O2S.C21H21F3N6O2S/c24-22(25,26)14-10-17-18(11-30)19(33(15-2-1-3-15)20(17)31-12-14)13-4-6-16(7-5-13)36(34,35)32-21(8-9-21)23(27,28)29;1-23(2,3)26-32(29,30)17-10-8-14(9-11-17)20-19(21(24)28)18-12-16(31-4)13-25-22(18)27(20)15-6-5-7-15;1-22(2,3)26-31(29,30)16-9-7-13(8-10-16)19-18(20(24)28)17-11-14(23)12-25-21(17)27(19)15-5-4-6-15;23-21(24,25)12-8-15-16(9-29)18(33(13-2-1-3-13)19(15)31-10-12)17-5-4-14(11-30-17)36(34,35)32-20(6-7-20)22(26,27)28;1-20(2,22(26,27)28)32-36(34,35)14-6-7-17(30-11-14)18-16(9-29)15-8-12(21(23,24)25)10-31-19(15)33(18)13-4-3-5-13;1-12(21(22,23)24)29-33(31,32)15-6-7-18(27-11-15)19-17(9-25)16-8-13(26-2)10-28-20(16)30(19)14-4-3-5-14/h4-7,10,12,15,32H,1-3,8-9H2;8-13,15,26H,5-7H2,1-4H3,(H2,24,28);7-12,15,26H,4-6H2,1-3H3,(H2,24,28);4-5,8,10-11,13,32H,1-3,6-7H2;6-8,10-11,13,32H,3-5H2,1-2H3;6-8,10-12,14,26,29H,3-5H2,1-2H3/t;;;;;12-/m.....0/s1
InChIKeySJMORIHBVKNZQM-QJNKDRDFSA-N
XLogP28.66
TPSA615.98 Ų
H-Bond Donors9
H-Bond Acceptors35
Rotatable Bonds32
Heavy Atoms204
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003001.55
LogP ≤ 528.66
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1035

Analyze 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide (CID 160852938) is 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide is CC(C)(C)NS(=O)(=O)c1ccc(-c2c(C(N)=O)c3cc(Cl)cnc3n2C2CCC2)cc1.CC(C)(NS(=O)(=O)c1ccc(-c2c(C#N)c3cc(C(F)(F)F)cnc3n2C2CCC2)nc1)C(F)(F)F.CNc1cnc2c(c1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCC1.CSc1cnc2c(c1)c(C(N)=O)c(-c1ccc(S(=O)(=O)NC(C)(C)C)cc1)n2C1CCC1.N#Cc1c(-c2ccc(S(=O)(=O)NC3(C(F)(F)F)CC3)cc2)n(C2CCC2)c2ncc(C(F)(F)F)cc12.N#Cc1c(-c2ccc(S(=O)(=O)NC3(C(F)(F)F)CC3)cn2)n(C2CCC2)c2ncc(C(F)(F)F)cc12.
What is the InChIKey of 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
The InChIKey is SJMORIHBVKNZQM-QJNKDRDFSA-N. The full InChI is InChI=1S/C23H18F6N4O2S.C23H28N4O3S2.C22H25ClN4O3S.C22H17F6N5O2S.C22H19F6N5O2S.C21H21F3N6O2S/c24-22(25,26)14-10-17-18(11-30)19(33(15-2-1-3-15)20(17)31-12-14)13-4-6-16(7-5-13)36(34,35)32-21(8-9-21)23(27,28)29;1-23(2,3)26-32(29,30)17-10-8-14(9-11-17)20-19(21(24)28)18-12-16(31-4)13-25-22(18)27(20)15-6-5-7-15;1-22(2,3)26-31(29,30)16-9-7-13(8-10-16)19-18(20(24)28)17-11-14(23)12-25-21(17)27(19)15-5-4-6-15;23-21(24,25)12-8-15-16(9-29)18(33(13-2-1-3-13)19(15)31-10-12)17-5-4-14(11-30-17)36(34,35)32-20(6-7-20)22(26,27)28;1-20(2,22(26,27)28)32-36(34,35)14-6-7-17(30-11-14)18-16(9-29)15-8-12(21(23,24)25)10-31-19(15)33(18)13-4-3-5-13;1-12(21(22,23)24)29-33(31,32)15-6-7-18(27-11-15)19-17(9-25)16-8-13(26-2)10-28-20(16)30(19)14-4-3-5-14/h4-7,10,12,15,32H,1-3,8-9H2;8-13,15,26H,5-7H2,1-4H3,(H2,24,28);7-12,15,26H,4-6H2,1-3H3,(H2,24,28);4-5,8,10-11,13,32H,1-3,6-7H2;6-8,10-11,13,32H,3-5H2,1-2H3;6-8,10-12,14,26,29H,3-5H2,1-2H3/t;;;;;12-/m.....0/s1.
What are the key properties of 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide?
2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide has a molecular weight of 3001.55 g/mol, XLogP of 28.66, 32 rotatable bonds, 9 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(tert-butylsulfamoyl)phenyl]-5-chloro-1-cyclobutylpyrrolo[2,3-b]pyridine-3-carboxamide;2-[4-(tert-butylsulfamoyl)phenyl]-1-cyclobutyl-5-methylsulfanylpyrrolo[2,3-b]pyridine-3-carboxamide;6-[3-cyano-1-cyclobutyl-5-(methylamino)pyrrolo[2,3-b]pyridin-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;4-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]benzenesulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-sulfonamide;6-[3-cyano-1-cyclobutyl-5-(trifluoromethyl)pyrrolo[2,3-b]pyridin-2-yl]-N-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 160852938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).