5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate

C157H170FN39O18S9 — CID 160651208

IUPAC5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
SMILESCOc1ccc(NC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.COc1cccc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1cc(F)cc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1ccc(S(=O)(=O)N2CCCN(C(=O)c3sc4nnc(C)c(C)c4c3N)CC2)cc1.Cc1nnc2sc(C(=O)N3CC(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCC(c4ccccc4)CC3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CCN(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCCN(C)C(=O)c3ccccc3)c(N)c2c1C
InChIInChI=1S/C21H25N5O3S2.C20H20FN5O3S.C20H22N6O3S.C20H21N5O4S.C20H22N4OS.C19H21N5O2S.C19H21N5OS.C18H18N4OS/c1-13-5-7-16(8-6-13)31(28,29)26-10-4-9-25(11-12-26)21(27)19-18(22)17-14(2)15(3)23-24-20(17)30-19;1-9-4-12(21)6-14(5-9)29-20(28)26-7-13(8-26)23-18(27)17-16(22)15-10(2)11(3)24-25-19(15)30-17;1-10-11(2)24-25-19-15(10)16(21)17(30-19)18(27)22-13-8-26(9-13)20(28)23-12-4-6-14(29-3)7-5-12;1-10-11(2)23-24-19-15(10)16(21)17(30-19)18(26)22-12-8-25(9-12)20(27)29-14-6-4-5-13(7-14)28-3;1-12-13(2)22-23-19-16(12)17(21)18(26-19)20(25)24-10-8-15(9-11-24)14-6-4-3-5-7-14;1-11-12(2)22-23-18-14(11)15(20)16(27-18)17(25)21-9-10-24(3)19(26)13-7-5-4-6-8-13;1-11-12(2)22-23-19-15(11)16(20)17(26-19)18(25)21-13-8-9-24(10-13)14-6-4-3-5-7-14;1-10-11(2)20-21-17-14(10)15(19)16(24-17)18(23)22-8-13(9-22)12-6-4-3-5-7-12/h5-8H,4,9-12,22H2,1-3H3;4-6,13H,7-8,22H2,1-3H3,(H,23,27);4-7,13H,8-9,21H2,1-3H3,(H,22,27)(H,23,28);4-7,12H,8-9,21H2,1-3H3,(H,22,26);3-7,15H,8-11,21H2,1-2H3;4-8H,9-10,20H2,1-3H3,(H,21,25);3-7,13H,8-10,20H2,1-2H3,(H,21,25);3-7,13H,8-9,19H2,1-2H3
InChIKeyRKLCXWWUJVCACS-UHFFFAOYSA-N
MW3198.94 g/mol
LogP23.07
Rot. Bonds26

About 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate

5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate (PubChem CID 160651208) has the molecular formula C157H170FN39O18S9 and a molecular weight of 3198.94 g/mol. Its IUPAC name is 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate.

Molecular Properties

Compound Name5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
PubChem CID160651208
Molecular FormulaC157H170FN39O18S9
Molecular Weight3198.94 g/mol
Exact Mass3196.11
IUPAC Name5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
SMILESCOc1ccc(NC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.COc1cccc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1cc(F)cc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1ccc(S(=O)(=O)N2CCCN(C(=O)c3sc4nnc(C)c(C)c4c3N)CC2)cc1.Cc1nnc2sc(C(=O)N3CC(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCC(c4ccccc4)CC3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CCN(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCCN(C)C(=O)c3ccccc3)c(N)c2c1C
InChIInChI=1S/C21H25N5O3S2.C20H20FN5O3S.C20H22N6O3S.C20H21N5O4S.C20H22N4OS.C19H21N5O2S.C19H21N5OS.C18H18N4OS/c1-13-5-7-16(8-6-13)31(28,29)26-10-4-9-25(11-12-26)21(27)19-18(22)17-14(2)15(3)23-24-20(17)30-19;1-9-4-12(21)6-14(5-9)29-20(28)26-7-13(8-26)23-18(27)17-16(22)15-10(2)11(3)24-25-19(15)30-17;1-10-11(2)24-25-19-15(10)16(21)17(30-19)18(27)22-13-8-26(9-13)20(28)23-12-4-6-14(29-3)7-5-12;1-10-11(2)23-24-19-15(10)16(21)17(30-19)18(26)22-12-8-25(9-12)20(27)29-14-6-4-5-13(7-14)28-3;1-12-13(2)22-23-19-16(12)17(21)18(26-19)20(25)24-10-8-15(9-11-24)14-6-4-3-5-7-14;1-11-12(2)22-23-18-14(11)15(20)16(27-18)17(25)21-9-10-24(3)19(26)13-7-5-4-6-8-13;1-11-12(2)22-23-19-15(11)16(20)17(26-19)18(25)21-13-8-9-24(10-13)14-6-4-3-5-7-14;1-10-11(2)20-21-17-14(10)15(19)16(24-17)18(23)22-8-13(9-22)12-6-4-3-5-7-12/h5-8H,4,9-12,22H2,1-3H3;4-6,13H,7-8,22H2,1-3H3,(H,23,27);4-7,13H,8-9,21H2,1-3H3,(H,22,27)(H,23,28);4-7,12H,8-9,21H2,1-3H3,(H,22,26);3-7,15H,8-11,21H2,1-2H3;4-8H,9-10,20H2,1-3H3,(H,21,25);3-7,13H,8-10,20H2,1-2H3,(H,21,25);3-7,13H,8-9,19H2,1-2H3
InChIKeyRKLCXWWUJVCACS-UHFFFAOYSA-N
XLogP23.07
TPSA791.64 Ų
H-Bond Donors14
H-Bond Acceptors51
Rotatable Bonds26
Heavy Atoms224
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003198.94
LogP ≤ 523.07
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1051

Analyze 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 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-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The IUPAC name of 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate (CID 160651208) is 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 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-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The canonical SMILES for 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate is COc1ccc(NC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.COc1cccc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1cc(F)cc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1ccc(S(=O)(=O)N2CCCN(C(=O)c3sc4nnc(C)c(C)c4c3N)CC2)cc1.Cc1nnc2sc(C(=O)N3CC(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CCC(c4ccccc4)CC3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CCN(c4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCCN(C)C(=O)c3ccccc3)c(N)c2c1C.
What is the InChIKey of 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The InChIKey is RKLCXWWUJVCACS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O3S2.C20H20FN5O3S.C20H22N6O3S.C20H21N5O4S.C20H22N4OS.C19H21N5O2S.C19H21N5OS.C18H18N4OS/c1-13-5-7-16(8-6-13)31(28,29)26-10-4-9-25(11-12-26)21(27)19-18(22)17-14(2)15(3)23-24-20(17)30-19;1-9-4-12(21)6-14(5-9)29-20(28)26-7-13(8-26)23-18(27)17-16(22)15-10(2)11(3)24-25-19(15)30-17;1-10-11(2)24-25-19-15(10)16(21)17(30-19)18(27)22-13-8-26(9-13)20(28)23-12-4-6-14(29-3)7-5-12;1-10-11(2)23-24-19-15(10)16(21)17(30-19)18(26)22-12-8-25(9-12)20(27)29-14-6-4-5-13(7-14)28-3;1-12-13(2)22-23-19-16(12)17(21)18(26-19)20(25)24-10-8-15(9-11-24)14-6-4-3-5-7-14;1-11-12(2)22-23-18-14(11)15(20)16(27-18)17(25)21-9-10-24(3)19(26)13-7-5-4-6-8-13;1-11-12(2)22-23-19-15(11)16(20)17(26-19)18(25)21-13-8-9-24(10-13)14-6-4-3-5-7-14;1-10-11(2)20-21-17-14(10)15(19)16(24-17)18(23)22-8-13(9-22)12-6-4-3-5-7-12/h5-8H,4,9-12,22H2,1-3H3;4-6,13H,7-8,22H2,1-3H3,(H,23,27);4-7,13H,8-9,21H2,1-3H3,(H,22,27)(H,23,28);4-7,12H,8-9,21H2,1-3H3,(H,22,26);3-7,15H,8-11,21H2,1-2H3;4-8H,9-10,20H2,1-3H3,(H,21,25);3-7,13H,8-10,20H2,1-2H3,(H,21,25);3-7,13H,8-9,19H2,1-2H3.
What are the key properties of 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate has a molecular weight of 3198.94 g/mol, XLogP of 23.07, 26 rotatable bonds, 14 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[2-[benzoyl(methyl)amino]ethyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-(1-phenylpyrrolidin-3-yl)thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-phenylpiperidin-1-yl)methanone;5-amino-N-[1-[(4-methoxyphenyl)carbamoyl]azetidin-3-yl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(3-fluoro-5-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;(3-methoxyphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate is sourced from PubChem (CID 160651208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).