8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine

C146H137F7N32O7 — CID 165081176

IUPAC8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine
SMILESCCCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cncnc23)c(C)c1.CN(C)C(=O)c1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)n(C)n1.CN(C)Cc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)cc1F.CN1CCc2cc(-c3cnc(NCc4c(F)ccc5c4CCO5)c4cnncc34)ccc2C1.CNCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)c(C)c1.Cc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cncnc23)n(C)n1
InChIInChI=1S/C26H24FN5O.C26H25FN4O.C25H23F2N5O.C25H24FN5O.C23H22FN7O2.C21H19FN6O/c1-32-8-6-16-10-17(2-3-18(16)15-32)20-11-28-26(23-14-31-30-13-21(20)23)29-12-22-19-7-9-33-25(19)5-4-24(22)27;1-3-4-17-5-6-18(16(2)11-17)21-14-30-26(22-12-28-15-31-25(21)22)29-13-20-19-9-10-32-24(19)8-7-23(20)27;1-32(2)14-16-4-3-15(9-23(16)27)18-10-28-25(21-13-31-30-12-19(18)21)29-11-20-17-7-8-33-24(17)6-5-22(20)26;1-15-9-16(10-27-2)3-4-17(15)19-11-28-25(22-14-31-30-13-20(19)22)29-12-21-18-7-8-32-24(18)6-5-23(21)26;1-30(2)23(32)19-8-20(31(3)29-19)16-10-26-22(17-12-28-27-11-14(16)17)25-9-15-13-6-7-33-21(13)5-4-18(15)24;1-12-7-18(28(2)27-12)15-10-25-21(16-8-23-11-26-20(15)16)24-9-14-13-5-6-29-19(13)4-3-17(14)22/h2-5,10-11,13-14H,6-9,12,15H2,1H3,(H,28,29);5-8,11-12,14-15H,3-4,9-10,13H2,1-2H3,(H,29,30);3-6,9-10,12-13H,7-8,11,14H2,1-2H3,(H,28,29);3-6,9,11,13-14,27H,7-8,10,12H2,1-2H3,(H,28,29);4-5,8,10-12H,6-7,9H2,1-3H3,(H,25,26);3-4,7-8,10-11H,5-6,9H2,1-2H3,(H,24,25)
InChIKeyVDOWLAMHJRIMDV-UHFFFAOYSA-N
MW2584.90 g/mol
LogP25.22
Rot. Bonds31

About 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine

8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine (PubChem CID 165081176) has the molecular formula C146H137F7N32O7 and a molecular weight of 2584.90 g/mol. Its IUPAC name is 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine.

Molecular Properties

Compound Name8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine
PubChem CID165081176
Molecular FormulaC146H137F7N32O7
Molecular Weight2584.90 g/mol
Exact Mass2583.12
IUPAC Name8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine
SMILESCCCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cncnc23)c(C)c1.CN(C)C(=O)c1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)n(C)n1.CN(C)Cc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)cc1F.CN1CCc2cc(-c3cnc(NCc4c(F)ccc5c4CCO5)c4cnncc34)ccc2C1.CNCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)c(C)c1.Cc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cncnc23)n(C)n1
InChIInChI=1S/C26H24FN5O.C26H25FN4O.C25H23F2N5O.C25H24FN5O.C23H22FN7O2.C21H19FN6O/c1-32-8-6-16-10-17(2-3-18(16)15-32)20-11-28-26(23-14-31-30-13-21(20)23)29-12-22-19-7-9-33-25(19)5-4-24(22)27;1-3-4-17-5-6-18(16(2)11-17)21-14-30-26(22-12-28-15-31-25(21)22)29-13-20-19-9-10-32-24(19)8-7-23(20)27;1-32(2)14-16-4-3-15(9-23(16)27)18-10-28-25(21-13-31-30-12-19(18)21)29-11-20-17-7-8-33-24(17)6-5-22(20)26;1-15-9-16(10-27-2)3-4-17(15)19-11-28-25(22-14-31-30-13-20(19)22)29-12-21-18-7-8-32-24(18)6-5-23(21)26;1-30(2)23(32)19-8-20(31(3)29-19)16-10-26-22(17-12-28-27-11-14(16)17)25-9-15-13-6-7-33-21(13)5-4-18(15)24;1-12-7-18(28(2)27-12)15-10-25-21(16-8-23-11-26-20(15)16)24-9-14-13-5-6-29-19(13)4-3-17(14)22/h2-5,10-11,13-14H,6-9,12,15H2,1H3,(H,28,29);5-8,11-12,14-15H,3-4,9-10,13H2,1-2H3,(H,29,30);3-6,9-10,12-13H,7-8,11,14H2,1-2H3,(H,28,29);3-6,9,11,13-14,27H,7-8,10,12H2,1-2H3,(H,28,29);4-5,8,10-12H,6-7,9H2,1-3H3,(H,25,26);3-4,7-8,10-11H,5-6,9H2,1-2H3,(H,24,25)
InChIKeyVDOWLAMHJRIMDV-UHFFFAOYSA-N
XLogP25.22
TPSA434.04 Ų
H-Bond Donors7
H-Bond Acceptors38
Rotatable Bonds31
Heavy Atoms192
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002584.90
LogP ≤ 525.22
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1038

Analyze 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine?
The IUPAC name of 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine (CID 165081176) is 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine.
What is the SMILES notation for 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine?
The canonical SMILES for 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine is CCCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cncnc23)c(C)c1.CN(C)C(=O)c1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)n(C)n1.CN(C)Cc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)cc1F.CN1CCc2cc(-c3cnc(NCc4c(F)ccc5c4CCO5)c4cnncc34)ccc2C1.CNCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cnncc23)c(C)c1.Cc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)c3cncnc23)n(C)n1.
What is the InChIKey of 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine?
The InChIKey is VDOWLAMHJRIMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24FN5O.C26H25FN4O.C25H23F2N5O.C25H24FN5O.C23H22FN7O2.C21H19FN6O/c1-32-8-6-16-10-17(2-3-18(16)15-32)20-11-28-26(23-14-31-30-13-21(20)23)29-12-22-19-7-9-33-25(19)5-4-24(22)27;1-3-4-17-5-6-18(16(2)11-17)21-14-30-26(22-12-28-15-31-25(21)22)29-13-20-19-9-10-32-24(19)8-7-23(20)27;1-32(2)14-16-4-3-15(9-23(16)27)18-10-28-25(21-13-31-30-12-19(18)21)29-11-20-17-7-8-33-24(17)6-5-22(20)26;1-15-9-16(10-27-2)3-4-17(15)19-11-28-25(22-14-31-30-13-20(19)22)29-12-21-18-7-8-32-24(18)6-5-23(21)26;1-30(2)23(32)19-8-20(31(3)29-19)16-10-26-22(17-12-28-27-11-14(16)17)25-9-15-13-6-7-33-21(13)5-4-18(15)24;1-12-7-18(28(2)27-12)15-10-25-21(16-8-23-11-26-20(15)16)24-9-14-13-5-6-29-19(13)4-3-17(14)22/h2-5,10-11,13-14H,6-9,12,15H2,1H3,(H,28,29);5-8,11-12,14-15H,3-4,9-10,13H2,1-2H3,(H,29,30);3-6,9-10,12-13H,7-8,11,14H2,1-2H3,(H,28,29);3-6,9,11,13-14,27H,7-8,10,12H2,1-2H3,(H,28,29);4-5,8,10-12H,6-7,9H2,1-3H3,(H,25,26);3-4,7-8,10-11H,5-6,9H2,1-2H3,(H,24,25).
What are the key properties of 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine?
8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine has a molecular weight of 2584.90 g/mol, XLogP of 25.22, 31 rotatable bonds, 7 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[4-[(dimethylamino)methyl]-3-fluorophenyl]-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[3,4-d]pyridazin-5-amine;8-(2,5-dimethylpyrazol-3-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]pyrido[4,3-d]pyrimidin-5-amine;5-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]pyrido[3,4-d]pyridazin-8-yl]-N,N,1-trimethylpyrazole-3-carboxamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-[2-methyl-4-(methylaminomethyl)phenyl]pyrido[3,4-d]pyridazin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-4-propylphenyl)pyrido[4,3-d]pyrimidin-5-amine is sourced from PubChem (CID 165081176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).