5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

C125H130N28O9S7 — CID 161278662

About 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (PubChem CID 161278662) has the molecular formula C125H130N28O9S7 and a molecular weight of 2393.07 g/mol. Its IUPAC name is 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

Molecular Properties

• Compound Name: 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• PubChem CID: 161278662
• Molecular Formula: C125H130N28O9S7
• Molecular Weight: 2393.07 g/mol
• Exact Mass: 2390.86
• IUPAC Name: 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• SMILES: Cc1nnc2sc(C(=O)N3CCC(NC(=O)CCc4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC34CC(C3)C4)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(-c4cncc5ccccc45)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(CN4CCCCC4)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(S(=O)(=O)c4ccccc4)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc4[nH]c(C)c(C)c4c3)c(N)c2c1C
• InChI: InChI=1S/C25H21N5OS.C22H25N5O2S.C22H27N5OS.C22H20N4O3S2.C20H21N5OS.C14H16N4OS/c1-14-15(2)29-30-25-21(14)22(26)23(32-25)24(31)28-11-16-7-9-17(10-8-16)20-13-27-12-18-5-3-4-6-19(18)20;1-13-14(2)25-26-21-18(13)19(23)20(30-21)22(29)27-11-10-16(12-27)24-17(28)9-8-15-6-4-3-5-7-15;1-14-15(2)25-26-22-18(14)19(23)20(29-22)21(28)24-12-16-6-8-17(9-7-16)13-27-10-4-3-5-11-27;1-13-14(2)25-26-22-18(13)19(23)20(30-22)21(27)24-12-15-8-10-17(11-9-15)31(28,29)16-6-4-3-5-7-16;1-9-11(3)23-15-6-5-13(7-14(9)15)8-22-19(26)18-17(21)16-10(2)12(4)24-25-20(16)27-18;1-6-7(2)17-18-13-9(6)10(15)11(20-13)12(19)16-14-3-8(4-14)5-14/h3-10,12-13H,11,26H2,1-2H3,(H,28,31);3-7,16H,8-12,23H2,1-2H3,(H,24,28);6-9H,3-5,10-13,23H2,1-2H3,(H,24,28);3-11H,12,23H2,1-2H3,(H,24,27);5-7,23H,8,21H2,1-4H3,(H,22,26);8H,3-5,15H2,1-2H3,(H,16,19)
• InChIKey: VETWXXQYSDVNSN-UHFFFAOYSA-N
• XLogP: 21.44
• TPSA: 571.77 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 35
• Rotatable Bonds: 24
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2393.07
LogP ≤ 5	21.44
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The IUPAC name of 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (CID 161278662) is 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

What is the SMILES notation for 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The canonical SMILES for 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is Cc1nnc2sc(C(=O)N3CCC(NC(=O)CCc4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC34CC(C3)C4)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(-c4cncc5ccccc45)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(CN4CCCCC4)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(S(=O)(=O)c4ccccc4)cc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc4[nH]c(C)c(C)c4c3)c(N)c2c1C.

What is the InChIKey of 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The InChIKey is VETWXXQYSDVNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5OS.C22H25N5O2S.C22H27N5OS.C22H20N4O3S2.C20H21N5OS.C14H16N4OS/c1-14-15(2)29-30-25-21(14)22(26)23(32-25)24(31)28-11-16-7-9-17(10-8-16)20-13-27-12-18-5-3-4-6-19(18)20;1-13-14(2)25-26-21-18(13)19(23)20(30-21)22(29)27-11-10-16(12-27)24-17(28)9-8-15-6-4-3-5-7-15;1-14-15(2)25-26-22-18(14)19(23)20(29-22)21(28)24-12-16-6-8-17(9-7-16)13-27-10-4-3-5-11-27;1-13-14(2)25-26-22-18(13)19(23)20(30-22)21(27)24-12-15-8-10-17(11-9-15)31(28,29)16-6-4-3-5-7-16;1-9-11(3)23-15-6-5-13(7-14(9)15)8-22-19(26)18-17(21)16-10(2)12(4)24-25-20(16)27-18;1-6-7(2)17-18-13-9(6)10(15)11(20-13)12(19)16-14-3-8(4-14)5-14/h3-10,12-13H,11,26H2,1-2H3,(H,28,31);3-7,16H,8-12,23H2,1-2H3,(H,24,28);6-9H,3-5,10-13,23H2,1-2H3,(H,24,28);3-11H,12,23H2,1-2H3,(H,24,27);5-7,23H,8,21H2,1-4H3,(H,22,26);8H,3-5,15H2,1-2H3,(H,16,19).

What are the key properties of 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide has a molecular weight of 2393.07 g/mol, XLogP of 21.44, 24 rotatable bonds, 13 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 5-amino-N-[[4-(benzenesulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-bicyclo[1.1.1]pentanyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-(piperidin-1-ylmethyl)phenyl]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-phenylpropanamide;5-amino-N-[(4-isoquinolin-4-ylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is sourced from PubChem (CID 161278662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).