5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

C118H124ClN33O12S8 — CID 157483963

About 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (PubChem CID 157483963) has the molecular formula C118H124ClN33O12S8 and a molecular weight of 2488.50 g/mol. Its IUPAC name is 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

Molecular Properties

• Compound Name: 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• PubChem CID: 157483963
• Molecular Formula: C118H124ClN33O12S8
• Molecular Weight: 2488.50 g/mol
• Exact Mass: 2485.76
• IUPAC Name: 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• SMILES: COc1ncccc1-c1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.Cc1cc(-c2ccc(CNC(=O)c3sc4nnc(C)c(C)c4c3N)cc2)cnc1Cl.Cc1nnc2sc(C(=O)N3CCC(NC(=O)N4CCOCC4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCC(NS(=O)(=O)c4cncn4C)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CCN(C(=O)c4cccs4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(-c4ccncc4)cc3)c(N)c2c1C
• InChI: InChI=1S/C22H20ClN5OS.C22H21N5O2S.C21H19N5OS.C18H24N6O3S.C18H19N5O2S2.C17H21N7O3S2/c1-11-8-16(10-25-20(11)23)15-6-4-14(5-7-15)9-26-21(29)19-18(24)17-12(2)13(3)27-28-22(17)30-19;1-12-13(2)26-27-22-17(12)18(23)19(30-22)20(28)25-11-14-6-8-15(9-7-14)16-5-4-10-24-21(16)29-3;1-12-13(2)25-26-21-17(12)18(22)19(28-21)20(27)24-11-14-3-5-15(6-4-14)16-7-9-23-10-8-16;1-10-11(2)21-22-16-13(10)14(19)15(28-16)17(25)24-4-3-12(9-24)20-18(26)23-5-7-27-8-6-23;1-9-10(2)21-22-17-13(9)14(19)15(27-17)16(24)20-11-5-6-23(8-11)18(25)12-4-3-7-26-12;1-9-10(2)20-21-16-13(9)14(18)15(28-16)17(25)24-5-4-11(7-24)22-29(26,27)12-6-19-8-23(12)3/h4-8,10H,9,24H2,1-3H3,(H,26,29);4-10H,11,23H2,1-3H3,(H,25,28);3-10H,11,22H2,1-2H3,(H,24,27);12H,3-9,19H2,1-2H3,(H,20,26);3-4,7,11H,5-6,8,19H2,1-2H3,(H,20,24);6,8,11,22H,4-5,7,18H2,1-3H3
• InChIKey: BWMJBBDGDSTTPO-UHFFFAOYSA-N
• XLogP: 17.18
• TPSA: 641.59 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 42
• Rotatable Bonds: 22
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2488.50
LogP ≤ 5	17.18
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	42

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The IUPAC name of 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (CID 157483963) is 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

What is the SMILES notation for 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The canonical SMILES for 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is COc1ncccc1-c1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.Cc1cc(-c2ccc(CNC(=O)c3sc4nnc(C)c(C)c4c3N)cc2)cnc1Cl.Cc1nnc2sc(C(=O)N3CCC(NC(=O)N4CCOCC4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCC(NS(=O)(=O)c4cncn4C)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CCN(C(=O)c4cccs4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(-c4ccncc4)cc3)c(N)c2c1C.

What is the InChIKey of 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The InChIKey is BWMJBBDGDSTTPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClN5OS.C22H21N5O2S.C21H19N5OS.C18H24N6O3S.C18H19N5O2S2.C17H21N7O3S2/c1-11-8-16(10-25-20(11)23)15-6-4-14(5-7-15)9-26-21(29)19-18(24)17-12(2)13(3)27-28-22(17)30-19;1-12-13(2)26-27-22-17(12)18(23)19(30-22)20(28)25-11-14-6-8-15(9-7-14)16-5-4-10-24-21(16)29-3;1-12-13(2)25-26-21-17(12)18(22)19(28-21)20(27)24-11-14-3-5-15(6-4-14)16-7-9-23-10-8-16;1-10-11(2)21-22-16-13(10)14(19)15(28-16)17(25)24-4-3-12(9-24)20-18(26)23-5-7-27-8-6-23;1-9-10(2)21-22-17-13(9)14(19)15(27-17)16(24)20-11-5-6-23(8-11)18(25)12-4-3-7-26-12;1-9-10(2)20-21-16-13(9)14(18)15(28-16)17(25)24-5-4-11(7-24)22-29(26,27)12-6-19-8-23(12)3/h4-8,10H,9,24H2,1-3H3,(H,26,29);4-10H,11,23H2,1-3H3,(H,25,28);3-10H,11,22H2,1-2H3,(H,24,27);12H,3-9,19H2,1-2H3,(H,20,26);3-4,7,11H,5-6,8,19H2,1-2H3,(H,20,24);6,8,11,22H,4-5,7,18H2,1-3H3.

What are the key properties of 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide has a molecular weight of 2488.50 g/mol, XLogP of 17.18, 22 rotatable bonds, 12 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for 5-amino-N-[[4-(6-chloro-5-methyl-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(4-pyridin-4-ylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]-3-methylimidazole-4-sulfonamide;N-[1-(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide;5-amino-3,4-dimethyl-N-[1-(thiophene-2-carbonyl)pyrrolidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[4-(2-methoxy-3-pyridinyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is sourced from PubChem (CID 157483963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).