5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide

C96H98N26O7S7 — CID 157109513

IUPAC5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide
SMILESCc1cc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)ccn1.Cc1cccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c1.Cc1nnc2sc(C(=O)NCc3ccc4c(c3)CCO4)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccccc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccccn3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccs3)c(N)c2c1C
InChIInChI=1S/C18H18N4O2S.C17H18N4OS.C16H17N5OS.C16H16N4OS.C15H15N5OS.C14H14N4OS2/c1-9-10(2)21-22-18-14(9)15(19)16(25-18)17(23)20-8-11-3-4-13-12(7-11)5-6-24-13;1-9-5-4-6-12(7-9)8-19-16(22)15-14(18)13-10(2)11(3)20-21-17(13)23-15;1-8-6-11(4-5-18-8)7-19-15(22)14-13(17)12-9(2)10(3)20-21-16(12)23-14;1-9-10(2)19-20-16-12(9)13(17)14(22-16)15(21)18-8-11-6-4-3-5-7-11;1-8-9(2)19-20-15-11(8)12(16)13(22-15)14(21)18-7-10-5-3-4-6-17-10;1-7-8(2)17-18-14-10(7)11(15)12(21-14)13(19)16-6-9-4-3-5-20-9/h3-4,7H,5-6,8,19H2,1-2H3,(H,20,23);4-7H,8,18H2,1-3H3,(H,19,22);4-6H,7,17H2,1-3H3,(H,19,22);3-7H,8,17H2,1-2H3,(H,18,21);3-6H,7,16H2,1-2H3,(H,18,21);3-5H,6,15H2,1-2H3,(H,16,19)
InChIKeyAGRJPSGBTDXIOS-UHFFFAOYSA-N
MW1952.48 g/mol
LogP16.33
Rot. Bonds18

About 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide

5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide (PubChem CID 157109513) has the molecular formula C96H98N26O7S7 and a molecular weight of 1952.48 g/mol. Its IUPAC name is 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide.

Molecular Properties

Compound Name5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide
PubChem CID157109513
Molecular FormulaC96H98N26O7S7
Molecular Weight1952.48 g/mol
Exact Mass1950.62
IUPAC Name5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide
SMILESCc1cc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)ccn1.Cc1cccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c1.Cc1nnc2sc(C(=O)NCc3ccc4c(c3)CCO4)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccccc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccccn3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccs3)c(N)c2c1C
InChIInChI=1S/C18H18N4O2S.C17H18N4OS.C16H17N5OS.C16H16N4OS.C15H15N5OS.C14H14N4OS2/c1-9-10(2)21-22-18-14(9)15(19)16(25-18)17(23)20-8-11-3-4-13-12(7-11)5-6-24-13;1-9-5-4-6-12(7-9)8-19-16(22)15-14(18)13-10(2)11(3)20-21-17(13)23-15;1-8-6-11(4-5-18-8)7-19-15(22)14-13(17)12-9(2)10(3)20-21-16(12)23-14;1-9-10(2)19-20-16-12(9)13(17)14(22-16)15(21)18-8-11-6-4-3-5-7-11;1-8-9(2)19-20-15-11(8)12(16)13(22-15)14(21)18-7-10-5-3-4-6-17-10;1-7-8(2)17-18-14-10(7)11(15)12(21-14)13(19)16-6-9-4-3-5-20-9/h3-4,7H,5-6,8,19H2,1-2H3,(H,20,23);4-7H,8,18H2,1-3H3,(H,19,22);4-6H,7,17H2,1-3H3,(H,19,22);3-7H,8,17H2,1-2H3,(H,18,21);3-6H,7,16H2,1-2H3,(H,18,21);3-5H,6,15H2,1-2H3,(H,16,19)
InChIKeyAGRJPSGBTDXIOS-UHFFFAOYSA-N
XLogP16.33
TPSA520.41 Ų
H-Bond Donors12
H-Bond Acceptors34
Rotatable Bonds18
Heavy Atoms136
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001952.48
LogP ≤ 516.33
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1034

Analyze 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide?
The IUPAC name of 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide (CID 157109513) is 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide.
What is the SMILES notation for 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide?
The canonical SMILES for 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide is Cc1cc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)ccn1.Cc1cccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)c1.Cc1nnc2sc(C(=O)NCc3ccc4c(c3)CCO4)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccccc3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccccn3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccs3)c(N)c2c1C.
What is the InChIKey of 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide?
The InChIKey is AGRJPSGBTDXIOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2S.C17H18N4OS.C16H17N5OS.C16H16N4OS.C15H15N5OS.C14H14N4OS2/c1-9-10(2)21-22-18-14(9)15(19)16(25-18)17(23)20-8-11-3-4-13-12(7-11)5-6-24-13;1-9-5-4-6-12(7-9)8-19-16(22)15-14(18)13-10(2)11(3)20-21-17(13)23-15;1-8-6-11(4-5-18-8)7-19-15(22)14-13(17)12-9(2)10(3)20-21-16(12)23-14;1-9-10(2)19-20-16-12(9)13(17)14(22-16)15(21)18-8-11-6-4-3-5-7-11;1-8-9(2)19-20-15-11(8)12(16)13(22-15)14(21)18-7-10-5-3-4-6-17-10;1-7-8(2)17-18-14-10(7)11(15)12(21-14)13(19)16-6-9-4-3-5-20-9/h3-4,7H,5-6,8,19H2,1-2H3,(H,20,23);4-7H,8,18H2,1-3H3,(H,19,22);4-6H,7,17H2,1-3H3,(H,19,22);3-7H,8,17H2,1-2H3,(H,18,21);3-6H,7,16H2,1-2H3,(H,18,21);3-5H,6,15H2,1-2H3,(H,16,19).
What are the key properties of 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide?
5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide has a molecular weight of 1952.48 g/mol, XLogP of 16.33, 18 rotatable bonds, 12 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-benzyl-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(3-methylphenyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[(2-methyl-4-pyridinyl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(pyridin-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(thiophen-2-ylmethyl)thieno[2,3-c]pyridazine-6-carboxamide is sourced from PubChem (CID 157109513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).