3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol

C179H138F2N46O7S — CID 157407203

IUPAC3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol
SMILESCC(=O)Nc1ccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)cc1.CC(=O)Nc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CNC(=O)c1cc(F)cc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CNC(=O)c1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CS(=O)(=O)Nc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.Fc1ccccc1-c1ccc2nnc(Cc3ccc4ncccc4c3)n2n1.NCc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.OCc1ccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)cc1
InChIInChI=1S/C23H17FN6O.3C23H18N6O.C22H18N6O2S.C22H18N6.C22H17N5O.C21H14FN5/c1-25-23(31)17-11-16(12-18(24)13-17)20-6-7-21-27-28-22(30(21)29-20)10-14-4-5-19-15(9-14)3-2-8-26-19;1-15(30)25-19-6-2-4-18(14-19)21-9-10-22-26-27-23(29(22)28-21)13-16-7-8-20-17(12-16)5-3-11-24-20;1-24-23(30)18-5-2-4-17(14-18)20-9-10-21-26-27-22(29(21)28-20)13-15-7-8-19-16(12-15)6-3-11-25-19;1-15(30)25-19-7-5-17(6-8-19)21-10-11-22-26-27-23(29(22)28-21)14-16-4-9-20-18(13-16)3-2-12-24-20;1-31(29,30)27-18-6-2-4-17(14-18)20-9-10-21-24-25-22(28(21)26-20)13-15-7-8-19-16(12-15)5-3-11-23-19;23-14-16-3-1-4-18(12-16)20-8-9-21-25-26-22(28(21)27-20)13-15-6-7-19-17(11-15)5-2-10-24-19;28-14-15-3-6-17(7-4-15)20-9-10-21-24-25-22(27(21)26-20)13-16-5-8-19-18(12-16)2-1-11-23-19;22-17-6-2-1-5-16(17)19-9-10-20-24-25-21(27(20)26-19)13-14-7-8-18-15(12-14)4-3-11-23-18/h2-9,11-13H,10H2,1H3,(H,25,31);2-12,14H,13H2,1H3,(H,25,30);2-12,14H,13H2,1H3,(H,24,30);2-13H,14H2,1H3,(H,25,30);2-12,14,27H,13H2,1H3;1-12H,13-14,23H2;1-12,28H,13-14H2;1-12H,13H2
InChIKeyBNVZCBVANQLVGC-UHFFFAOYSA-N
MW3115.45 g/mol
LogP28.68
Rot. Bonds32

About 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol

3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol (PubChem CID 157407203) has the molecular formula C179H138F2N46O7S and a molecular weight of 3115.45 g/mol. Its IUPAC name is 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol.

Molecular Properties

Compound Name3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol
PubChem CID157407203
Molecular FormulaC179H138F2N46O7S
Molecular Weight3115.45 g/mol
Exact Mass3113.15
IUPAC Name3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol
SMILESCC(=O)Nc1ccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)cc1.CC(=O)Nc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CNC(=O)c1cc(F)cc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CNC(=O)c1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CS(=O)(=O)Nc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.Fc1ccccc1-c1ccc2nnc(Cc3ccc4ncccc4c3)n2n1.NCc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.OCc1ccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)cc1
InChIInChI=1S/C23H17FN6O.3C23H18N6O.C22H18N6O2S.C22H18N6.C22H17N5O.C21H14FN5/c1-25-23(31)17-11-16(12-18(24)13-17)20-6-7-21-27-28-22(30(21)29-20)10-14-4-5-19-15(9-14)3-2-8-26-19;1-15(30)25-19-6-2-4-18(14-19)21-9-10-22-26-27-23(29(22)28-21)13-16-7-8-20-17(12-16)5-3-11-24-20;1-24-23(30)18-5-2-4-17(14-18)20-9-10-21-26-27-22(29(21)28-20)13-15-7-8-19-16(12-15)6-3-11-25-19;1-15(30)25-19-7-5-17(6-8-19)21-10-11-22-26-27-23(29(22)28-21)14-16-4-9-20-18(13-16)3-2-12-24-20;1-31(29,30)27-18-6-2-4-17(14-18)20-9-10-21-24-25-22(28(21)26-20)13-15-7-8-19-16(12-15)5-3-11-23-19;23-14-16-3-1-4-18(12-16)20-8-9-21-25-26-22(28(21)27-20)13-15-6-7-19-17(11-15)5-2-10-24-19;28-14-15-3-6-17(7-4-15)20-9-10-21-24-25-22(27(21)26-20)13-16-5-8-19-18(12-16)2-1-11-23-19;22-17-6-2-1-5-16(17)19-9-10-20-24-25-21(27(20)26-19)13-14-7-8-18-15(12-14)4-3-11-23-18/h2-9,11-13H,10H2,1H3,(H,25,31);2-12,14H,13H2,1H3,(H,25,30);2-12,14H,13H2,1H3,(H,24,30);2-13H,14H2,1H3,(H,25,30);2-12,14,27H,13H2,1H3;1-12H,13-14,23H2;1-12,28H,13-14H2;1-12H,13H2
InChIKeyBNVZCBVANQLVGC-UHFFFAOYSA-N
XLogP28.68
TPSA656.58 Ų
H-Bond Donors7
H-Bond Acceptors48
Rotatable Bonds32
Heavy Atoms235
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003115.45
LogP ≤ 528.68
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1048

Analyze 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol?
The IUPAC name of 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol (CID 157407203) is 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol.
What is the SMILES notation for 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol?
The canonical SMILES for 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol is CC(=O)Nc1ccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)cc1.CC(=O)Nc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CNC(=O)c1cc(F)cc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CNC(=O)c1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.CS(=O)(=O)Nc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.Fc1ccccc1-c1ccc2nnc(Cc3ccc4ncccc4c3)n2n1.NCc1cccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)c1.OCc1ccc(-c2ccc3nnc(Cc4ccc5ncccc5c4)n3n2)cc1.
What is the InChIKey of 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol?
The InChIKey is BNVZCBVANQLVGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17FN6O.3C23H18N6O.C22H18N6O2S.C22H18N6.C22H17N5O.C21H14FN5/c1-25-23(31)17-11-16(12-18(24)13-17)20-6-7-21-27-28-22(30(21)29-20)10-14-4-5-19-15(9-14)3-2-8-26-19;1-15(30)25-19-6-2-4-18(14-19)21-9-10-22-26-27-23(29(22)28-21)13-16-7-8-20-17(12-16)5-3-11-24-20;1-24-23(30)18-5-2-4-17(14-18)20-9-10-21-26-27-22(29(21)28-20)13-15-7-8-19-16(12-15)6-3-11-25-19;1-15(30)25-19-7-5-17(6-8-19)21-10-11-22-26-27-23(29(22)28-21)14-16-4-9-20-18(13-16)3-2-12-24-20;1-31(29,30)27-18-6-2-4-17(14-18)20-9-10-21-24-25-22(28(21)26-20)13-15-7-8-19-16(12-15)5-3-11-23-19;23-14-16-3-1-4-18(12-16)20-8-9-21-25-26-22(28(21)27-20)13-15-6-7-19-17(11-15)5-2-10-24-19;28-14-15-3-6-17(7-4-15)20-9-10-21-24-25-22(27(21)26-20)13-16-5-8-19-18(12-16)2-1-11-23-19;22-17-6-2-1-5-16(17)19-9-10-20-24-25-21(27(20)26-19)13-14-7-8-18-15(12-14)4-3-11-23-18/h2-9,11-13H,10H2,1H3,(H,25,31);2-12,14H,13H2,1H3,(H,25,30);2-12,14H,13H2,1H3,(H,24,30);2-13H,14H2,1H3,(H,25,30);2-12,14,27H,13H2,1H3;1-12H,13-14,23H2;1-12,28H,13-14H2;1-12H,13H2.
What are the key properties of 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol?
3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol has a molecular weight of 3115.45 g/mol, XLogP of 28.68, 32 rotatable bonds, 7 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-methyl-5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;6-[[6-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;N-methyl-3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]benzamide;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;N-[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]acetamide;[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanamine;N-[3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanesulfonamide;[4-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]methanol is sourced from PubChem (CID 157407203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).