N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide

C88H80Cl2F3N21O8S4 — CID 159196063

IUPACN-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide
SMILESCn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(C(F)(F)F)c4)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(Cl)c4Cl)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4ccccc4)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccnc4)cc3)cc(C3CC3)nc21
InChIInChI=1S/C23H20F3N5O2S.C22H19Cl2N5O2S.C22H21N5O2S.C21H20N6O2S/c1-31-22-20(21(27)29-31)18(12-19(28-22)14-5-6-14)13-7-9-16(10-8-13)30-34(32,33)17-4-2-3-15(11-17)23(24,25)26;1-29-22-19(21(25)27-29)15(11-17(26-22)13-5-6-13)12-7-9-14(10-8-12)28-32(30,31)18-4-2-3-16(23)20(18)24;1-27-22-20(21(23)25-27)18(13-19(24-22)15-7-8-15)14-9-11-16(12-10-14)26-30(28,29)17-5-3-2-4-6-17;1-27-21-19(20(22)25-27)17(11-18(24-21)14-4-5-14)13-6-8-15(9-7-13)26-30(28,29)16-3-2-10-23-12-16/h2-4,7-12,14,30H,5-6H2,1H3,(H2,27,29);2-4,7-11,13,28H,5-6H2,1H3,(H2,25,27);2-6,9-13,15,26H,7-8H2,1H3,(H2,23,25);2-3,6-12,14,26H,4-5H2,1H3,(H2,22,25)
InChIKeyKORGQVCKKCNLTR-UHFFFAOYSA-N
MW1815.91 g/mol
LogP17.30
Rot. Bonds20

About N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide

N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide (PubChem CID 159196063) has the molecular formula C88H80Cl2F3N21O8S4 and a molecular weight of 1815.91 g/mol. Its IUPAC name is N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide
PubChem CID159196063
Molecular FormulaC88H80Cl2F3N21O8S4
Molecular Weight1815.91 g/mol
Exact Mass1813.47
IUPAC NameN-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide
SMILESCn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(C(F)(F)F)c4)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(Cl)c4Cl)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4ccccc4)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccnc4)cc3)cc(C3CC3)nc21
InChIInChI=1S/C23H20F3N5O2S.C22H19Cl2N5O2S.C22H21N5O2S.C21H20N6O2S/c1-31-22-20(21(27)29-31)18(12-19(28-22)14-5-6-14)13-7-9-16(10-8-13)30-34(32,33)17-4-2-3-15(11-17)23(24,25)26;1-29-22-19(21(25)27-29)15(11-17(26-22)13-5-6-13)12-7-9-14(10-8-12)28-32(30,31)18-4-2-3-16(23)20(18)24;1-27-22-20(21(23)25-27)18(13-19(24-22)15-7-8-15)14-9-11-16(12-10-14)26-30(28,29)17-5-3-2-4-6-17;1-27-21-19(20(22)25-27)17(11-18(24-21)14-4-5-14)13-6-8-15(9-7-13)26-30(28,29)16-3-2-10-23-12-16/h2-4,7-12,14,30H,5-6H2,1H3,(H2,27,29);2-4,7-11,13,28H,5-6H2,1H3,(H2,25,27);2-6,9-13,15,26H,7-8H2,1H3,(H2,23,25);2-3,6-12,14,26H,4-5H2,1H3,(H2,22,25)
InChIKeyKORGQVCKKCNLTR-UHFFFAOYSA-N
XLogP17.30
TPSA424.49 Ų
H-Bond Donors8
H-Bond Acceptors25
Rotatable Bonds20
Heavy Atoms126
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001815.91
LogP ≤ 517.30
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1025

Analyze N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide (CID 159196063) is N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide is Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(C(F)(F)F)c4)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccc(Cl)c4Cl)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4ccccc4)cc3)cc(C3CC3)nc21.Cn1nc(N)c2c(-c3ccc(NS(=O)(=O)c4cccnc4)cc3)cc(C3CC3)nc21.
What is the InChIKey of N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide?
The InChIKey is KORGQVCKKCNLTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F3N5O2S.C22H19Cl2N5O2S.C22H21N5O2S.C21H20N6O2S/c1-31-22-20(21(27)29-31)18(12-19(28-22)14-5-6-14)13-7-9-16(10-8-13)30-34(32,33)17-4-2-3-15(11-17)23(24,25)26;1-29-22-19(21(25)27-29)15(11-17(26-22)13-5-6-13)12-7-9-14(10-8-12)28-32(30,31)18-4-2-3-16(23)20(18)24;1-27-22-20(21(23)25-27)18(13-19(24-22)15-7-8-15)14-9-11-16(12-10-14)26-30(28,29)17-5-3-2-4-6-17;1-27-21-19(20(22)25-27)17(11-18(24-21)14-4-5-14)13-6-8-15(9-7-13)26-30(28,29)16-3-2-10-23-12-16/h2-4,7-12,14,30H,5-6H2,1H3,(H2,27,29);2-4,7-11,13,28H,5-6H2,1H3,(H2,25,27);2-6,9-13,15,26H,7-8H2,1H3,(H2,23,25);2-3,6-12,14,26H,4-5H2,1H3,(H2,22,25).
What are the key properties of N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide?
N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide has a molecular weight of 1815.91 g/mol, XLogP of 17.30, 20 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]benzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2,3-dichlorobenzenesulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]pyridine-3-sulfonamide;N-[4-(3-amino-6-cyclopropyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 159196063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).