5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate

C147H155F5N38O17S9 — CID 159351539

IUPAC5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
SMILESCCOc1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.COC(=O)N1CC(NC(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1ccc(C(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.Cc1cccc(F)c1C(=O)N1CC(NC(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1nnc2sc(C(=O)N3CCC(c4ccncc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)Cc4cccs4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)c4ccc(OC(C)(F)F)cc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccc(OC(C)(F)F)c3)c(N)c2c1C
InChIInChI=1S/C21H21F2N5O3S.C20H20FN5O2S.C20H21N5O2S.C18H18F2N4O2S.C18H19N5O2S2.C18H19N5OS.C18H20N4O2S.C14H17N5O3S/c1-10-11(2)26-27-19-15(10)16(24)17(32-19)18(29)25-13-8-28(9-13)20(30)12-4-6-14(7-5-12)31-21(3,22)23;1-9-5-4-6-13(21)14(9)20(28)26-7-12(8-26)23-18(27)17-16(22)15-10(2)11(3)24-25-19(15)29-17;1-10-4-6-13(7-5-10)20(27)25-8-14(9-25)22-18(26)17-16(21)15-11(2)12(3)23-24-19(15)28-17;1-9-10(2)23-24-17-13(9)14(21)15(27-17)16(25)22-8-11-5-4-6-12(7-11)26-18(3,19)20;1-9-10(2)21-22-18-14(9)15(19)16(27-18)17(25)20-11-7-23(8-11)13(24)6-12-4-3-5-26-12;1-10-11(2)21-22-17-14(10)15(19)16(25-17)18(24)23-8-5-13(9-23)12-3-6-20-7-4-12;1-4-24-13-7-5-12(6-8-13)9-20-17(23)16-15(19)14-10(2)11(3)21-22-18(14)25-16;1-6-7(2)17-18-13-9(6)10(15)11(23-13)12(20)16-8-4-19(5-8)14(21)22-3/h4-7,13H,8-9,24H2,1-3H3,(H,25,29);4-6,12H,7-8,22H2,1-3H3,(H,23,27);4-7,14H,8-9,21H2,1-3H3,(H,22,26);4-7H,8,21H2,1-3H3,(H,22,25);3-5,11H,6-8,19H2,1-2H3,(H,20,25);3-4,6-7,13H,5,8-9,19H2,1-2H3;5-8H,4,9,19H2,1-3H3,(H,20,23);8H,4-5,15H2,1-3H3,(H,16,20)
InChIKeyLHJTZHMEFBRCFH-UHFFFAOYSA-N
MW3109.70 g/mol
LogP21.33
Rot. Bonds29

About 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate

5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate (PubChem CID 159351539) has the molecular formula C147H155F5N38O17S9 and a molecular weight of 3109.70 g/mol. Its IUPAC name is 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate.

Molecular Properties

Compound Name5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
PubChem CID159351539
Molecular FormulaC147H155F5N38O17S9
Molecular Weight3109.70 g/mol
Exact Mass3106.98
IUPAC Name5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
SMILESCCOc1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.COC(=O)N1CC(NC(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1ccc(C(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.Cc1cccc(F)c1C(=O)N1CC(NC(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1nnc2sc(C(=O)N3CCC(c4ccncc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)Cc4cccs4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)c4ccc(OC(C)(F)F)cc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccc(OC(C)(F)F)c3)c(N)c2c1C
InChIInChI=1S/C21H21F2N5O3S.C20H20FN5O2S.C20H21N5O2S.C18H18F2N4O2S.C18H19N5O2S2.C18H19N5OS.C18H20N4O2S.C14H17N5O3S/c1-10-11(2)26-27-19-15(10)16(24)17(32-19)18(29)25-13-8-28(9-13)20(30)12-4-6-14(7-5-12)31-21(3,22)23;1-9-5-4-6-13(21)14(9)20(28)26-7-12(8-26)23-18(27)17-16(22)15-10(2)11(3)24-25-19(15)29-17;1-10-4-6-13(7-5-10)20(27)25-8-14(9-25)22-18(26)17-16(21)15-11(2)12(3)23-24-19(15)28-17;1-9-10(2)23-24-17-13(9)14(21)15(27-17)16(25)22-8-11-5-4-6-12(7-11)26-18(3,19)20;1-9-10(2)21-22-18-14(9)15(19)16(27-18)17(25)20-11-7-23(8-11)13(24)6-12-4-3-5-26-12;1-10-11(2)21-22-17-14(10)15(19)16(25-17)18(24)23-8-5-13(9-23)12-3-6-20-7-4-12;1-4-24-13-7-5-12(6-8-13)9-20-17(23)16-15(19)14-10(2)11(3)21-22-18(14)25-16;1-6-7(2)17-18-13-9(6)10(15)11(23-13)12(20)16-8-4-19(5-8)14(21)22-3/h4-7,13H,8-9,24H2,1-3H3,(H,25,29);4-6,12H,7-8,22H2,1-3H3,(H,23,27);4-7,14H,8-9,21H2,1-3H3,(H,22,26);4-7H,8,21H2,1-3H3,(H,22,25);3-5,11H,6-8,19H2,1-2H3,(H,20,25);3-4,6-7,13H,5,8-9,19H2,1-2H3;5-8H,4,9,19H2,1-3H3,(H,20,23);8H,4-5,15H2,1-3H3,(H,16,20)
InChIKeyLHJTZHMEFBRCFH-UHFFFAOYSA-N
XLogP21.33
TPSA789.77 Ų
H-Bond Donors15
H-Bond Acceptors51
Rotatable Bonds29
Heavy Atoms216
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003109.70
LogP ≤ 521.33
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1051

Analyze 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The IUPAC name of 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate (CID 159351539) is 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate.
What is the SMILES notation for 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The canonical SMILES for 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate is CCOc1ccc(CNC(=O)c2sc3nnc(C)c(C)c3c2N)cc1.COC(=O)N1CC(NC(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1ccc(C(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.Cc1cccc(F)c1C(=O)N1CC(NC(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1nnc2sc(C(=O)N3CCC(c4ccncc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)Cc4cccs4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)c4ccc(OC(C)(F)F)cc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3cccc(OC(C)(F)F)c3)c(N)c2c1C.
What is the InChIKey of 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The InChIKey is LHJTZHMEFBRCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21F2N5O3S.C20H20FN5O2S.C20H21N5O2S.C18H18F2N4O2S.C18H19N5O2S2.C18H19N5OS.C18H20N4O2S.C14H17N5O3S/c1-10-11(2)26-27-19-15(10)16(24)17(32-19)18(29)25-13-8-28(9-13)20(30)12-4-6-14(7-5-12)31-21(3,22)23;1-9-5-4-6-13(21)14(9)20(28)26-7-12(8-26)23-18(27)17-16(22)15-10(2)11(3)24-25-19(15)29-17;1-10-4-6-13(7-5-10)20(27)25-8-14(9-25)22-18(26)17-16(21)15-11(2)12(3)23-24-19(15)28-17;1-9-10(2)23-24-17-13(9)14(21)15(27-17)16(25)22-8-11-5-4-6-12(7-11)26-18(3,19)20;1-9-10(2)21-22-18-14(9)15(19)16(27-18)17(25)20-11-7-23(8-11)13(24)6-12-4-3-5-26-12;1-10-11(2)21-22-17-14(10)15(19)16(25-17)18(24)23-8-5-13(9-23)12-3-6-20-7-4-12;1-4-24-13-7-5-12(6-8-13)9-20-17(23)16-15(19)14-10(2)11(3)21-22-18(14)25-16;1-6-7(2)17-18-13-9(6)10(15)11(23-13)12(20)16-8-4-19(5-8)14(21)22-3/h4-7,13H,8-9,24H2,1-3H3,(H,25,29);4-6,12H,7-8,22H2,1-3H3,(H,23,27);4-7,14H,8-9,21H2,1-3H3,(H,22,26);4-7H,8,21H2,1-3H3,(H,22,25);3-5,11H,6-8,19H2,1-2H3,(H,20,25);3-4,6-7,13H,5,8-9,19H2,1-2H3;5-8H,4,9,19H2,1-3H3,(H,20,23);8H,4-5,15H2,1-3H3,(H,16,20).
What are the key properties of 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate has a molecular weight of 3109.70 g/mol, XLogP of 21.33, 29 rotatable bonds, 15 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-[4-(1,1-difluoroethoxy)benzoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[[3-(1,1-difluoroethoxy)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(4-methylbenzoyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;5-amino-3,4-dimethyl-N-[1-(2-thiophen-2-ylacetyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[(4-ethoxyphenyl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-[1-(2-fluoro-6-methylbenzoyl)azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;methyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate is sourced from PubChem (CID 159351539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).