(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate

C132H147F2N31O13S9 — CID 159653946

About (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate

(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate (PubChem CID 159653946) has the molecular formula C132H147F2N31O13S9 and a molecular weight of 2702.43 g/mol. Its IUPAC name is (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate.

Molecular Properties

• Compound Name: (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate
• PubChem CID: 159653946
• Molecular Formula: C132H147F2N31O13S9
• Molecular Weight: 2702.43 g/mol
• Exact Mass: 2699.92
• IUPAC Name: (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate
• SMILES: CCCOC(=O)NC(CC)CNC(=O)c1sc2nnc(C)c(C)c2c1N.COc1ccc(C2CCN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.COc1cccc(SC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1ccc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.Cc1ccc(SC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)c(F)c1.Cc1nnc2sc(C(=O)N3CCC(c4ccccc4)C3C)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(C(C)F)nc3)c(N)c2c1C
• InChI: InChI=1S/C20H21N5O3S.C20H22N4O2S.C20H22N4OS.C19H19FN4OS2.C19H20N4O2S2.C17H18FN5OS.C17H25N5O3S/c1-10-4-6-14(7-5-10)28-20(27)25-8-13(9-25)22-18(26)17-16(21)15-11(2)12(3)23-24-19(15)29-17;1-11-12(2)22-23-19-16(11)17(21)18(27-19)20(25)24-9-8-14(10-24)13-4-6-15(26-3)7-5-13;1-11-12(2)22-23-19-16(11)17(21)18(26-19)20(25)24-10-9-15(13(24)3)14-7-5-4-6-8-14;1-9-4-5-14(13(20)6-9)26-12-7-24(8-12)19(25)17-16(21)15-10(2)11(3)22-23-18(15)27-17;1-10-11(2)21-22-18-15(10)16(20)17(27-18)19(24)23-8-14(9-23)26-13-6-4-5-12(7-13)25-3;1-8-10(3)22-23-17-13(8)14(19)15(25-17)16(24)21-7-11-4-5-12(9(2)18)20-6-11;1-5-7-25-17(24)20-11(6-2)8-19-15(23)14-13(18)12-9(3)10(4)21-22-16(12)26-14/h4-7,13H,8-9,21H2,1-3H3,(H,22,26);4-7,14H,8-10,21H2,1-3H3;4-8,13,15H,9-10,21H2,1-3H3;4-6,12H,7-8,21H2,1-3H3;4-7,14H,8-9,20H2,1-3H3;4-6,9H,7,19H2,1-3H3,(H,21,24);11H,5-8,18H2,1-4H3,(H,19,23)(H,20,24)
• InChIKey: MRXYMCOWGCKYCI-UHFFFAOYSA-N
• XLogP: 23.50
• TPSA: 630.36 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 44
• Rotatable Bonds: 26
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2702.43
LogP ≤ 5	23.50
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	44

Frequently Asked Questions

What is the IUPAC name of (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate?

The IUPAC name of (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate (CID 159653946) is (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate.

What is the SMILES notation for (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate?

The canonical SMILES for (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate is CCCOC(=O)NC(CC)CNC(=O)c1sc2nnc(C)c(C)c2c1N.COc1ccc(C2CCN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.COc1cccc(SC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)c1.Cc1ccc(OC(=O)N2CC(NC(=O)c3sc4nnc(C)c(C)c4c3N)C2)cc1.Cc1ccc(SC2CN(C(=O)c3sc4nnc(C)c(C)c4c3N)C2)c(F)c1.Cc1nnc2sc(C(=O)N3CCC(c4ccccc4)C3C)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc(C(C)F)nc3)c(N)c2c1C.

What is the InChIKey of (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate?

The InChIKey is MRXYMCOWGCKYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O3S.C20H22N4O2S.C20H22N4OS.C19H19FN4OS2.C19H20N4O2S2.C17H18FN5OS.C17H25N5O3S/c1-10-4-6-14(7-5-10)28-20(27)25-8-13(9-25)22-18(26)17-16(21)15-11(2)12(3)23-24-19(15)29-17;1-11-12(2)22-23-19-16(11)17(21)18(27-19)20(25)24-9-8-14(10-24)13-4-6-15(26-3)7-5-13;1-11-12(2)22-23-19-16(11)17(21)18(26-19)20(25)24-10-9-15(13(24)3)14-7-5-4-6-8-14;1-9-4-5-14(13(20)6-9)26-12-7-24(8-12)19(25)17-16(21)15-10(2)11(3)22-23-18(15)27-17;1-10-11(2)21-22-18-15(10)16(20)17(27-18)19(24)23-8-14(9-23)26-13-6-4-5-12(7-13)25-3;1-8-10(3)22-23-17-13(8)14(19)15(25-17)16(24)21-7-11-4-5-12(9(2)18)20-6-11;1-5-7-25-17(24)20-11(6-2)8-19-15(23)14-13(18)12-9(3)10(4)21-22-16(12)26-14/h4-7,13H,8-9,21H2,1-3H3,(H,22,26);4-7,14H,8-10,21H2,1-3H3;4-8,13,15H,9-10,21H2,1-3H3;4-6,12H,7-8,21H2,1-3H3;4-7,14H,8-9,20H2,1-3H3;4-6,9H,7,19H2,1-3H3,(H,21,24);11H,5-8,18H2,1-4H3,(H,19,23)(H,20,24).

What are the key properties of (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate?

(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate has a molecular weight of 2702.43 g/mol, XLogP of 23.50, 26 rotatable bonds, 11 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for (5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(2-fluoro-4-methylphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-[3-(3-methoxyphenyl)sulfanylazetidin-1-yl]methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;5-amino-N-[[6-(1-fluoroethyl)-3-pyridinyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;(4-methylphenyl) 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate;propyl N-[1-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]butan-2-yl]carbamate is sourced from PubChem (CID 159653946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).