5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

C113H120F3N25O10S7 — CID 160557116

About 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide

5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (PubChem CID 160557116) has the molecular formula C113H120F3N25O10S7 and a molecular weight of 2269.83 g/mol. Its IUPAC name is 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

Molecular Properties

• Compound Name: 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• PubChem CID: 160557116
• Molecular Formula: C113H120F3N25O10S7
• Molecular Weight: 2269.83 g/mol
• Exact Mass: 2267.76
• IUPAC Name: 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
• SMILES: C=S(C)(=O)c1cccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c1.COC1(c2cccc(C)c2)CN(C(=O)c2sc3nnc(C)c(C)c3c2N)C1.COc1ccc(C2(NC(=O)c3sc4nnc(C)c(C)c4c3N)CC2)cc1.COc1cccc(C2(F)CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1cc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c(F)cc1F.Cc1ccc(CN2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1
• InChI: InChI=1S/C20H23N5OS.C20H22N4O2S.C19H19FN4O2S.C19H20N4O2S.C18H20N4O2S2.C17H16F2N4OS/c1-11-4-6-14(7-5-11)8-25-9-15(10-25)22-19(26)18-17(21)16-12(2)13(3)23-24-20(16)27-18;1-11-6-5-7-14(8-11)20(26-4)9-24(10-20)19(25)17-16(21)15-12(2)13(3)22-23-18(15)27-17;1-10-11(2)22-23-17-14(10)15(21)16(27-17)18(25)24-8-19(20,9-24)12-5-4-6-13(7-12)26-3;1-10-11(2)22-23-18-14(10)15(20)16(26-18)17(24)21-19(8-9-19)12-4-6-13(25-3)7-5-12;1-10-11(2)21-22-18-14(10)15(19)16(25-18)17(23)20-9-12-6-5-7-13(8-12)26(3,4)24;1-7-4-10(12(19)5-11(7)18)6-21-16(24)15-14(20)13-8(2)9(3)22-23-17(13)25-15/h4-7,15H,8-10,21H2,1-3H3,(H,22,26);5-8H,9-10,21H2,1-4H3;4-7H,8-9,21H2,1-3H3;4-7H,8-9,20H2,1-3H3,(H,21,24);5-8H,3,9,19H2,1-2,4H3,(H,20,23);4-5H,6,20H2,1-3H3,(H,21,24)
• InChIKey: QYVHATRTTJZAKG-UHFFFAOYSA-N
• XLogP: 18.48
• TPSA: 515.82 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 35
• Rotatable Bonds: 21
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2269.83
LogP ≤ 5	18.48
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The IUPAC name of 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide (CID 160557116) is 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide.

What is the SMILES notation for 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The canonical SMILES for 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is C=S(C)(=O)c1cccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c1.COC1(c2cccc(C)c2)CN(C(=O)c2sc3nnc(C)c(C)c3c2N)C1.COc1ccc(C2(NC(=O)c3sc4nnc(C)c(C)c4c3N)CC2)cc1.COc1cccc(C2(F)CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1cc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c(F)cc1F.Cc1ccc(CN2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.

What is the InChIKey of 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

The InChIKey is QYVHATRTTJZAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5OS.C20H22N4O2S.C19H19FN4O2S.C19H20N4O2S.C18H20N4O2S2.C17H16F2N4OS/c1-11-4-6-14(7-5-11)8-25-9-15(10-25)22-19(26)18-17(21)16-12(2)13(3)23-24-20(16)27-18;1-11-6-5-7-14(8-11)20(26-4)9-24(10-20)19(25)17-16(21)15-12(2)13(3)22-23-18(15)27-17;1-10-11(2)22-23-17-14(10)15(21)16(27-17)18(25)24-8-19(20,9-24)12-5-4-6-13(7-12)26-3;1-10-11(2)22-23-18-14(10)15(20)16(26-18)17(24)21-19(8-9-19)12-4-6-13(25-3)7-5-12;1-10-11(2)21-22-18-14(10)15(19)16(25-18)17(23)20-9-12-6-5-7-13(8-12)26(3,4)24;1-7-4-10(12(19)5-11(7)18)6-21-16(24)15-14(20)13-8(2)9(3)22-23-17(13)25-15/h4-7,15H,8-10,21H2,1-3H3,(H,22,26);5-8H,9-10,21H2,1-4H3;4-7H,8-9,21H2,1-3H3;4-7H,8-9,20H2,1-3H3,(H,21,24);5-8H,3,9,19H2,1-2,4H3,(H,20,23);4-5H,6,20H2,1-3H3,(H,21,24).

What are the key properties of 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide?

5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide has a molecular weight of 2269.83 g/mol, XLogP of 18.48, 21 rotatable bonds, 10 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 5-amino-N-[(2,4-difluoro-5-methylphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[[3-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl]methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-[(4-methylphenyl)methyl]azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-fluoro-3-(3-methoxyphenyl)azetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-methoxy-3-(3-methylphenyl)azetidin-1-yl]methanone;5-amino-N-[1-(4-methoxyphenyl)cyclopropyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide is sourced from PubChem (CID 160557116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).