4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide

C134H136F15N27O15S7 — CID 161299693

IUPAC4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
SMILESCC(C)Oc1cnc2c(c1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCC1.CCc1cc2c(C#N)c(-c3ccc(S(=O)(=O)NS(=O)(=O)C(C)C)cc3)n(C3CCC3)c2cn1.CCc1cc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cc3)n(C3CCC3)c2cn1.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cccnc3n2C2CCCC2)nc1)C(F)(F)F.Cc1ccc2c(n1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCCC1.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@H](C)C(F)(F)F)cc3)n(C3CCC3)c2c1
InChIInChI=1S/C23H24F3N5O3S.C23H23F3N4O2S.C23H26N4O4S2.C22H22F3N5O2S.C22H21F3N4O2S.C21H20F3N5O2S/c1-13(2)34-16-9-18-19(10-27)21(31(15-5-4-6-15)22(18)29-11-16)20-8-7-17(12-28-20)35(32,33)30-14(3)23(24,25)26;1-3-16-11-19-20(12-27)22(30(17-5-4-6-17)21(19)13-28-16)15-7-9-18(10-8-15)33(31,32)29-14(2)23(24,25)26;1-4-17-12-20-21(13-24)23(27(18-6-5-7-18)22(20)14-25-17)16-8-10-19(11-9-16)33(30,31)26-32(28,29)15(2)3;1-13-7-10-19-20(28-13)17(11-26)21(30(19)15-5-3-4-6-15)18-9-8-16(12-27-18)33(31,32)29-14(2)22(23,24)25;1-13-10-19-20(27-12-13)18(11-26)21(29(19)16-4-3-5-16)15-6-8-17(9-7-15)32(30,31)28-14(2)22(23,24)25;1-13(21(22,23)24)28-32(30,31)15-8-9-18(27-12-15)19-17(11-25)16-7-4-10-26-20(16)29(19)14-5-2-3-6-14/h7-9,11-15,30H,4-6H2,1-3H3;7-11,13-14,17,29H,3-6H2,1-2H3;8-12,14-15,18,26H,4-7H2,1-3H3;7-10,12,14-15,29H,3-6H2,1-2H3;6-10,12,14,16,28H,3-5H2,1-2H3;4,7-10,12-14,28H,2-3,5-6H2,1H3/t2*14-;;2*14-;13-/m00.010/s1
InChIKeyVHLBDFHVNKSISV-OGLXZZDESA-N
MW2874.17 g/mol
LogP27.46
Rot. Bonds35

About 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide

4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide (PubChem CID 161299693) has the molecular formula C134H136F15N27O15S7 and a molecular weight of 2874.17 g/mol. Its IUPAC name is 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
PubChem CID161299693
Molecular FormulaC134H136F15N27O15S7
Molecular Weight2874.17 g/mol
Exact Mass2871.85
IUPAC Name4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide
SMILESCC(C)Oc1cnc2c(c1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCC1.CCc1cc2c(C#N)c(-c3ccc(S(=O)(=O)NS(=O)(=O)C(C)C)cc3)n(C3CCC3)c2cn1.CCc1cc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cc3)n(C3CCC3)c2cn1.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cccnc3n2C2CCCC2)nc1)C(F)(F)F.Cc1ccc2c(n1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCCC1.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@H](C)C(F)(F)F)cc3)n(C3CCC3)c2c1
InChIInChI=1S/C23H24F3N5O3S.C23H23F3N4O2S.C23H26N4O4S2.C22H22F3N5O2S.C22H21F3N4O2S.C21H20F3N5O2S/c1-13(2)34-16-9-18-19(10-27)21(31(15-5-4-6-15)22(18)29-11-16)20-8-7-17(12-28-20)35(32,33)30-14(3)23(24,25)26;1-3-16-11-19-20(12-27)22(30(17-5-4-6-17)21(19)13-28-16)15-7-9-18(10-8-15)33(31,32)29-14(2)23(24,25)26;1-4-17-12-20-21(13-24)23(27(18-6-5-7-18)22(20)14-25-17)16-8-10-19(11-9-16)33(30,31)26-32(28,29)15(2)3;1-13-7-10-19-20(28-13)17(11-26)21(30(19)15-5-3-4-6-15)18-9-8-16(12-27-18)33(31,32)29-14(2)22(23,24)25;1-13-10-19-20(27-12-13)18(11-26)21(29(19)16-4-3-5-16)15-6-8-17(9-7-15)32(30,31)28-14(2)22(23,24)25;1-13(21(22,23)24)28-32(30,31)15-8-9-18(27-12-15)19-17(11-25)16-7-4-10-26-20(16)29(19)14-5-2-3-6-14/h7-9,11-15,30H,4-6H2,1-3H3;7-11,13-14,17,29H,3-6H2,1-2H3;8-12,14-15,18,26H,4-7H2,1-3H3;7-10,12,14-15,29H,3-6H2,1-2H3;6-10,12,14,16,28H,3-5H2,1-2H3;4,7-10,12-14,28H,2-3,5-6H2,1H3/t2*14-;;2*14-;13-/m00.010/s1
InChIKeyVHLBDFHVNKSISV-OGLXZZDESA-N
XLogP27.46
TPSA608.72 Ų
H-Bond Donors6
H-Bond Acceptors36
Rotatable Bonds35
Heavy Atoms198
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002874.17
LogP ≤ 527.46
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1036

Analyze 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
The IUPAC name of 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide (CID 161299693) is 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide.
What is the SMILES notation for 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
The canonical SMILES for 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide is CC(C)Oc1cnc2c(c1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCC1.CCc1cc2c(C#N)c(-c3ccc(S(=O)(=O)NS(=O)(=O)C(C)C)cc3)n(C3CCC3)c2cn1.CCc1cc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cc3)n(C3CCC3)c2cn1.C[C@H](NS(=O)(=O)c1ccc(-c2c(C#N)c3cccnc3n2C2CCCC2)nc1)C(F)(F)F.Cc1ccc2c(n1)c(C#N)c(-c1ccc(S(=O)(=O)N[C@@H](C)C(F)(F)F)cn1)n2C1CCCC1.Cc1cnc2c(C#N)c(-c3ccc(S(=O)(=O)N[C@H](C)C(F)(F)F)cc3)n(C3CCC3)c2c1.
What is the InChIKey of 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
The InChIKey is VHLBDFHVNKSISV-OGLXZZDESA-N. The full InChI is InChI=1S/C23H24F3N5O3S.C23H23F3N4O2S.C23H26N4O4S2.C22H22F3N5O2S.C22H21F3N4O2S.C21H20F3N5O2S/c1-13(2)34-16-9-18-19(10-27)21(31(15-5-4-6-15)22(18)29-11-16)20-8-7-17(12-28-20)35(32,33)30-14(3)23(24,25)26;1-3-16-11-19-20(12-27)22(30(17-5-4-6-17)21(19)13-28-16)15-7-9-18(10-8-15)33(31,32)29-14(2)23(24,25)26;1-4-17-12-20-21(13-24)23(27(18-6-5-7-18)22(20)14-25-17)16-8-10-19(11-9-16)33(30,31)26-32(28,29)15(2)3;1-13-7-10-19-20(28-13)17(11-26)21(30(19)15-5-3-4-6-15)18-9-8-16(12-27-18)33(31,32)29-14(2)22(23,24)25;1-13-10-19-20(27-12-13)18(11-26)21(29(19)16-4-3-5-16)15-6-8-17(9-7-15)32(30,31)28-14(2)22(23,24)25;1-13(21(22,23)24)28-32(30,31)15-8-9-18(27-12-15)19-17(11-25)16-7-4-10-26-20(16)29(19)14-5-2-3-6-14/h7-9,11-15,30H,4-6H2,1-3H3;7-11,13-14,17,29H,3-6H2,1-2H3;8-12,14-15,18,26H,4-7H2,1-3H3;7-10,12,14-15,29H,3-6H2,1-2H3;6-10,12,14,16,28H,3-5H2,1-2H3;4,7-10,12-14,28H,2-3,5-6H2,1H3/t2*14-;;2*14-;13-/m00.010/s1.
What are the key properties of 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide?
4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide has a molecular weight of 2874.17 g/mol, XLogP of 27.46, 35 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-propan-2-ylsulfonylbenzenesulfonamide;4-(3-cyano-1-cyclobutyl-5-ethylpyrrolo[2,3-c]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;4-(3-cyano-1-cyclobutyl-6-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2R)-1,1,1-trifluoropropan-2-yl]benzenesulfonamide;6-(3-cyano-1-cyclobutyl-5-propan-2-yloxypyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentyl-5-methylpyrrolo[3,2-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-1-cyclopentylpyrrolo[2,3-b]pyridin-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 161299693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).