5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

C111H127N27O11S9 — CID 160783220

About 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (PubChem CID 160783220) has the molecular formula C111H127N27O11S9 and a molecular weight of 2304.02 g/mol. Its IUPAC name is 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

Molecular Properties

• Compound Name: 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• PubChem CID: 160783220
• Molecular Formula: C111H127N27O11S9
• Molecular Weight: 2304.02 g/mol
• Exact Mass: 2301.77
• IUPAC Name: 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• SMILES: C=S(C)(=O)Cc1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.C=S(C)(=O)c1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cn1.C=S(C)(=O)c1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)nc1.COc1ccc(C(C)CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.COc1ccc(C2(CNC(=O)c3sc4nnc(C)c(C)c4c3N)CC2)cc1.Cc1nnc2sc(C(=O)NCc3ccc(CN(C)C)cc3)c(N)c2c1C
• InChI: InChI=1S/C20H22N4O2S.C19H23N5OS.C19H22N4O2S2.C19H22N4O2S.2C17H19N5O2S2/c1-11-12(2)23-24-19-15(11)16(21)17(27-19)18(25)22-10-20(8-9-20)13-4-6-14(26-3)7-5-13;1-11-12(2)22-23-19-15(11)16(20)17(26-19)18(25)21-9-13-5-7-14(8-6-13)10-24(3)4;1-11-12(2)22-23-19-15(11)16(20)17(26-19)18(24)21-9-13-5-7-14(8-6-13)10-27(3,4)25;1-10(13-5-7-14(25-4)8-6-13)9-21-18(24)17-16(20)15-11(2)12(3)22-23-19(15)26-17;1-9-10(2)21-22-17-13(9)14(18)15(25-17)16(23)20-7-11-5-6-12(8-19-11)26(3,4)24;1-9-10(2)21-22-17-13(9)14(18)15(25-17)16(23)20-8-11-5-6-12(19-7-11)26(3,4)24/h4-7H,8-10,21H2,1-3H3,(H,22,25);5-8H,9-10,20H2,1-4H3,(H,21,25);5-8H,3,9-10,20H2,1-2,4H3,(H,21,24);5-8,10H,9,20H2,1-4H3,(H,21,24);5-6,8H,3,7,18H2,1-2,4H3,(H,20,23);5-7H,3,8,18H2,1-2,4H3,(H,20,23)
• InChIKey: SAVWZJKSCOFEOF-UHFFFAOYSA-N
• XLogP: 16.18
• TPSA: 584.09 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 38
• Rotatable Bonds: 28
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2304.02
LogP ≤ 5	16.18
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The IUPAC name of 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (CID 160783220) is 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

What is the SMILES notation for 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The canonical SMILES for 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is C=S(C)(=O)Cc1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.C=S(C)(=O)c1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cn1.C=S(C)(=O)c1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)nc1.COc1ccc(C(C)CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.COc1ccc(C2(CNC(=O)c3sc4nnc(C)c(C)c4c3N)CC2)cc1.Cc1nnc2sc(C(=O)NCc3ccc(CN(C)C)cc3)c(N)c2c1C.

What is the InChIKey of 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The InChIKey is SAVWZJKSCOFEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2S.C19H23N5OS.C19H22N4O2S2.C19H22N4O2S.2C17H19N5O2S2/c1-11-12(2)23-24-19-15(11)16(21)17(27-19)18(25)22-10-20(8-9-20)13-4-6-14(26-3)7-5-13;1-11-12(2)22-23-19-15(11)16(20)17(26-19)18(25)21-9-13-5-7-14(8-6-13)10-24(3)4;1-11-12(2)22-23-19-15(11)16(20)17(26-19)18(24)21-9-13-5-7-14(8-6-13)10-27(3,4)25;1-10(13-5-7-14(25-4)8-6-13)9-21-18(24)17-16(20)15-11(2)12(3)22-23-19(15)26-17;1-9-10(2)21-22-17-13(9)14(18)15(25-17)16(23)20-7-11-5-6-12(8-19-11)26(3,4)24;1-9-10(2)21-22-17-13(9)14(18)15(25-17)16(23)20-8-11-5-6-12(19-7-11)26(3,4)24/h4-7H,8-10,21H2,1-3H3,(H,22,25);5-8H,9-10,20H2,1-4H3,(H,21,25);5-8H,3,9-10,20H2,1-2,4H3,(H,21,24);5-8,10H,9,20H2,1-4H3,(H,21,24);5-6,8H,3,7,18H2,1-2,4H3,(H,20,23);5-7H,3,8,18H2,1-2,4H3,(H,20,23).

What are the key properties of 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide has a molecular weight of 2304.02 g/mol, XLogP of 16.18, 28 rotatable bonds, 12 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 5-amino-N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[4-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[5-(methyl-methylidene-oxo-λ6-sulfanyl)-2-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[6-(methyl-methylidene-oxo-λ6-sulfanyl)-3-pyridinyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[2-(4-methoxyphenyl)propyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is sourced from PubChem (CID 160783220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).