1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide

C163H206N34O23 — CID 160633365

About 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide

1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide (PubChem CID 160633365) has the molecular formula C163H206N34O23 and a molecular weight of 3009.66 g/mol. Its IUPAC name is 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide.

Molecular Properties

• Compound Name: 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide
• PubChem CID: 160633365
• Molecular Formula: C163H206N34O23
• Molecular Weight: 3009.66 g/mol
• Exact Mass: 3007.60
• IUPAC Name: 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide
• SMILES: C.C.C.C.C.CC(=O)N1CCC(C(=O)N/C(=N\C2CCCCN(CC(=O)N3CCCC3)C2=O)Nc2ccc3oc(C)cc3c2)CC1.CNC(=O)c1cc(C(=O)N/C(=N\C2CCCCN(CC(=O)N3CCCC3)C2=O)Nc2ccc3oc(C)cc3c2)ccn1.Cc1cc2cc(N/C(=N/C3CCCCN(CC(=O)N4CCCC4)C3=O)NC(=O)c3ccc(C(=O)N4CCC(N(C)C)C4)nc3)ccc2o1.Cc1cc2cc(N/C(=N/[C@H]3CCCCN(CC(=O)N4CCCC4)C3=O)NC(=O)c3ccc4ncccc4c3)ccc2o1.Cc1cc2cc(N/C(=N/[C@H]3CCCCN(CC(=O)N4CCCC4)C3=O)NC(=O)c3ccc4nccnc4c3)ccc2o1
• InChI: InChI=1S/C35H44N8O5.C32H34N6O4.C31H33N7O4.C30H35N7O5.C30H40N6O5.5CH4/c1-23-18-25-19-26(10-12-30(25)48-23)37-35(38-29-8-4-5-16-42(34(29)47)22-31(44)41-14-6-7-15-41)39-32(45)24-9-11-28(36-20-24)33(46)43-17-13-27(21-43)40(2)3;1-21-17-24-19-25(10-12-28(24)42-21)34-32(36-30(40)23-9-11-26-22(18-23)7-6-13-33-26)35-27-8-2-3-16-38(31(27)41)20-29(39)37-14-4-5-15-37;1-20-16-22-17-23(8-10-27(22)42-20)34-31(36-29(40)21-7-9-24-26(18-21)33-12-11-32-24)35-25-6-2-3-15-38(30(25)41)19-28(39)37-13-4-5-14-37;1-19-15-21-16-22(8-9-25(21)42-19)33-30(35-27(39)20-10-11-32-24(17-20)28(40)31-2)34-23-7-3-4-14-37(29(23)41)18-26(38)36-12-5-6-13-36;1-20-17-23-18-24(8-9-26(23)41-20)31-30(33-28(39)22-10-15-34(16-11-22)21(2)37)32-25-7-3-4-14-36(29(25)40)19-27(38)35-12-5-6-13-35;;;;;/h9-12,18-20,27,29H,4-8,13-17,21-22H2,1-3H3,(H2,37,38,39,45);6-7,9-13,17-19,27H,2-5,8,14-16,20H2,1H3,(H2,34,35,36,40);7-12,16-18,25H,2-6,13-15,19H2,1H3,(H2,34,35,36,40);8-11,15-17,23H,3-7,12-14,18H2,1-2H3,(H,31,40)(H2,33,34,35,39);8-9,17-18,22,25H,3-7,10-16,19H2,1-2H3,(H2,31,32,33,39);5*1H4/t;27-;25-;;;;;;;/m.00......./s1
• InChIKey: RIFCQVKFLRYXPH-BWDZMRRJSA-N
• XLogP: 20.26
• TPSA: 673.66 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 34
• Rotatable Bonds: 28
• Heavy Atoms: 220
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3009.66
LogP ≤ 5	20.26
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide?

The IUPAC name of 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide (CID 160633365) is 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide.

What is the SMILES notation for 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide?

The canonical SMILES for 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide is C.C.C.C.C.CC(=O)N1CCC(C(=O)N/C(=N\C2CCCCN(CC(=O)N3CCCC3)C2=O)Nc2ccc3oc(C)cc3c2)CC1.CNC(=O)c1cc(C(=O)N/C(=N\C2CCCCN(CC(=O)N3CCCC3)C2=O)Nc2ccc3oc(C)cc3c2)ccn1.Cc1cc2cc(N/C(=N/C3CCCCN(CC(=O)N4CCCC4)C3=O)NC(=O)c3ccc(C(=O)N4CCC(N(C)C)C4)nc3)ccc2o1.Cc1cc2cc(N/C(=N/[C@H]3CCCCN(CC(=O)N4CCCC4)C3=O)NC(=O)c3ccc4ncccc4c3)ccc2o1.Cc1cc2cc(N/C(=N/[C@H]3CCCCN(CC(=O)N4CCCC4)C3=O)NC(=O)c3ccc4nccnc4c3)ccc2o1.

What is the InChIKey of 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide?

The InChIKey is RIFCQVKFLRYXPH-BWDZMRRJSA-N. The full InChI is InChI=1S/C35H44N8O5.C32H34N6O4.C31H33N7O4.C30H35N7O5.C30H40N6O5.5CH4/c1-23-18-25-19-26(10-12-30(25)48-23)37-35(38-29-8-4-5-16-42(34(29)47)22-31(44)41-14-6-7-15-41)39-32(45)24-9-11-28(36-20-24)33(46)43-17-13-27(21-43)40(2)3;1-21-17-24-19-25(10-12-28(24)42-21)34-32(36-30(40)23-9-11-26-22(18-23)7-6-13-33-26)35-27-8-2-3-16-38(31(27)41)20-29(39)37-14-4-5-15-37;1-20-16-22-17-23(8-10-27(22)42-20)34-31(36-29(40)21-7-9-24-26(18-21)33-12-11-32-24)35-25-6-2-3-15-38(30(25)41)19-28(39)37-13-4-5-14-37;1-19-15-21-16-22(8-9-25(21)42-19)33-30(35-27(39)20-10-11-32-24(17-20)28(40)31-2)34-23-7-3-4-14-37(29(23)41)18-26(38)36-12-5-6-13-36;1-20-17-23-18-24(8-9-26(23)41-20)31-30(33-28(39)22-10-15-34(16-11-22)21(2)37)32-25-7-3-4-14-36(29(25)40)19-27(38)35-12-5-6-13-35;;;;;/h9-12,18-20,27,29H,4-8,13-17,21-22H2,1-3H3,(H2,37,38,39,45);6-7,9-13,17-19,27H,2-5,8,14-16,20H2,1H3,(H2,34,35,36,40);7-12,16-18,25H,2-6,13-15,19H2,1H3,(H2,34,35,36,40);8-11,15-17,23H,3-7,12-14,18H2,1-2H3,(H,31,40)(H2,33,34,35,39);8-9,17-18,22,25H,3-7,10-16,19H2,1-2H3,(H2,31,32,33,39);5*1H4/t;27-;25-;;;;;;;/m.00......./s1.

What are the key properties of 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide?

1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide has a molecular weight of 3009.66 g/mol, XLogP of 20.26, 28 rotatable bonds, 11 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 1-acetyl-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]piperidine-4-carboxamide;6-[3-(dimethylamino)pyrrolidine-1-carbonyl]-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-3-carboxamide;methane;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoline-6-carboxamide;N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]quinoxaline-6-carboxamide;2-N-methyl-4-N-[N-(2-methyl-1-benzofuran-5-yl)-N'-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl]pyridine-2,4-dicarboxamide is sourced from PubChem (CID 160633365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).