N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide

C138H114Cl7F18N37O8 — CID 160531733

About N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide

N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide (PubChem CID 160531733) has the molecular formula C138H114Cl7F18N37O8 and a molecular weight of 3008.82 g/mol. Its IUPAC name is N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide.

Molecular Properties

• Compound Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide
• PubChem CID: 160531733
• Molecular Formula: C138H114Cl7F18N37O8
• Molecular Weight: 3008.82 g/mol
• Exact Mass: 3003.72
• IUPAC Name: N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide
• SMILES: NCc1ccc(Cl)cc1CNC(=O)Cc1ccnc(NCC(F)(F)c2ccccn2)c1F.O=C(Cc1c(Cl)cnc(NCC(F)(F)c2cccc[n+]2[O-])c1F)NCc1cc(Cl)ccc1-n1cncn1.O=C(Cc1c(Cl)cnc(NCC(F)(F)c2cccc[n+]2[O-])c1F)NCc1cncc2ccccc12.O=C(Cc1c(Cl)cnc(NCC(F)(F)c2ccccn2)c1F)NCc1cncc2ccccc12.O=C(Cc1ccnc(NCC(F)(F)c2ccccn2)c1F)NCc1cc(Cl)ccc1-n1cncn1.O=C(Cc1ccnc(NCC(F)(F)c2ccccn2)c1F)NCc1cc(Cl)ccc1-n1cnnn1
• InChI: InChI=1S/C24H19ClF3N5O2.C24H19ClF3N5O.C23H18Cl2F3N7O2.C23H19ClF3N7O.C22H18ClF3N8O.C22H21ClF3N5O/c25-19-13-31-23(32-14-24(27,28)20-7-3-4-8-33(20)35)22(26)18(19)9-21(34)30-12-16-11-29-10-15-5-1-2-6-17(15)16;25-19-13-32-23(33-14-24(27,28)20-7-3-4-8-30-20)22(26)18(19)9-21(34)31-12-16-11-29-10-15-5-1-2-6-17(15)16;24-15-4-5-18(34-13-29-12-33-34)14(7-15)9-30-20(36)8-16-17(25)10-31-22(21(16)26)32-11-23(27,28)19-3-1-2-6-35(19)37;24-17-4-5-18(34-14-28-13-33-34)16(9-17)11-31-20(35)10-15-6-8-30-22(21(15)25)32-12-23(26,27)19-3-1-2-7-29-19;23-16-4-5-17(34-13-31-32-33-34)15(9-16)11-29-19(35)10-14-6-8-28-21(20(14)24)30-12-22(25,26)18-3-1-2-7-27-18;23-17-5-4-15(11-27)16(9-17)12-30-19(32)10-14-6-8-29-21(20(14)24)31-13-22(25,26)18-3-1-2-7-28-18/h1-8,10-11,13H,9,12,14H2,(H,30,34)(H,31,32);1-8,10-11,13H,9,12,14H2,(H,31,34)(H,32,33);1-7,10,12-13H,8-9,11H2,(H,30,36)(H,31,32);1-9,13-14H,10-12H2,(H,30,32)(H,31,35);1-9,13H,10-12H2,(H,28,30)(H,29,35);1-9H,10-13,27H2,(H,29,31)(H,30,32)
• InChIKey: QVQCONYFOJCMLB-UHFFFAOYSA-N
• XLogP: 23.81
• TPSA: 586.38 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 37
• Rotatable Bonds: 52
• Heavy Atoms: 208
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3008.82
LogP ≤ 5	23.81
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide?

The IUPAC name of N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide (CID 160531733) is N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide.

What is the SMILES notation for N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide?

The canonical SMILES for N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide is NCc1ccc(Cl)cc1CNC(=O)Cc1ccnc(NCC(F)(F)c2ccccn2)c1F.O=C(Cc1c(Cl)cnc(NCC(F)(F)c2cccc[n+]2[O-])c1F)NCc1cc(Cl)ccc1-n1cncn1.O=C(Cc1c(Cl)cnc(NCC(F)(F)c2cccc[n+]2[O-])c1F)NCc1cncc2ccccc12.O=C(Cc1c(Cl)cnc(NCC(F)(F)c2ccccn2)c1F)NCc1cncc2ccccc12.O=C(Cc1ccnc(NCC(F)(F)c2ccccn2)c1F)NCc1cc(Cl)ccc1-n1cncn1.O=C(Cc1ccnc(NCC(F)(F)c2ccccn2)c1F)NCc1cc(Cl)ccc1-n1cnnn1.

What is the InChIKey of N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide?

The InChIKey is QVQCONYFOJCMLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClF3N5O2.C24H19ClF3N5O.C23H18Cl2F3N7O2.C23H19ClF3N7O.C22H18ClF3N8O.C22H21ClF3N5O/c25-19-13-31-23(32-14-24(27,28)20-7-3-4-8-33(20)35)22(26)18(19)9-21(34)30-12-16-11-29-10-15-5-1-2-6-17(15)16;25-19-13-32-23(33-14-24(27,28)20-7-3-4-8-30-20)22(26)18(19)9-21(34)31-12-16-11-29-10-15-5-1-2-6-17(15)16;24-15-4-5-18(34-13-29-12-33-34)14(7-15)9-30-20(36)8-16-17(25)10-31-22(21(16)26)32-11-23(27,28)19-3-1-2-6-35(19)37;24-17-4-5-18(34-14-28-13-33-34)16(9-17)11-31-20(35)10-15-6-8-30-22(21(15)25)32-12-23(26,27)19-3-1-2-7-29-19;23-16-4-5-17(34-13-31-32-33-34)15(9-16)11-29-19(35)10-14-6-8-28-21(20(14)24)30-12-22(25,26)18-3-1-2-7-27-18;23-17-5-4-15(11-27)16(9-17)12-30-19(32)10-14-6-8-29-21(20(14)24)31-13-22(25,26)18-3-1-2-7-28-18/h1-8,10-11,13H,9,12,14H2,(H,30,34)(H,31,32);1-8,10-11,13H,9,12,14H2,(H,31,34)(H,32,33);1-7,10,12-13H,8-9,11H2,(H,30,36)(H,31,32);1-9,13-14H,10-12H2,(H,30,32)(H,31,35);1-9,13H,10-12H2,(H,28,30)(H,29,35);1-9H,10-13,27H2,(H,29,31)(H,30,32).

What are the key properties of N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide?

N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide has a molecular weight of 3008.82 g/mol, XLogP of 23.81, 52 rotatable bonds, 13 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]acetamide;2-[5-chloro-2-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;2-[5-chloro-2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]-N-(isoquinolin-4-ylmethyl)acetamide;N-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide;N-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-[2-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-3-fluoro-4-pyridinyl]acetamide is sourced from PubChem (CID 160531733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).