N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide

C155H153Cl6FN18O11 — CID 160581159

About N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide

N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide (PubChem CID 160581159) has the molecular formula C155H153Cl6FN18O11 and a molecular weight of 2675.76 g/mol. Its IUPAC name is N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide.

Molecular Properties

• Compound Name: N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide
• PubChem CID: 160581159
• Molecular Formula: C155H153Cl6FN18O11
• Molecular Weight: 2675.76 g/mol
• Exact Mass: 2671.01
• IUPAC Name: N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide
• SMILES: CC(C)CN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1Cl.CCCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1Cl.CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1Cl.CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1ccc(OC)c(F)c1.COc1ccc(C(=O)N(CCC(C)C)Cc2nc3ccccc3n2-c2ccccc2)cc1O.COc1ccc(C(=O)N(Cc2nc3ccccc3n2-c2ccccc2)CC(C)C)cc1O
• InChI: InChI=1S/C27H29N3O3.C26H25Cl2N3O.C26H26FN3O2.C26H27N3O3.2C25H23Cl2N3O/c1-19(2)15-16-29(27(32)20-13-14-25(33-3)24(31)17-20)18-26-28-22-11-7-8-12-23(22)30(26)21-9-5-4-6-10-21;1-2-3-9-16-30(26(32)21-17-19(27)14-15-22(21)28)18-25-29-23-12-7-8-13-24(23)31(25)20-10-5-4-6-11-20;1-3-4-16-29(26(31)19-14-15-24(32-2)21(27)17-19)18-25-28-22-12-8-9-13-23(22)30(25)20-10-6-5-7-11-20;1-18(2)16-28(26(31)19-13-14-24(32-3)23(30)15-19)17-25-27-21-11-7-8-12-22(21)29(25)20-9-5-4-6-10-20;1-17(2)15-29(25(31)20-14-18(26)12-13-21(20)27)16-24-28-22-10-6-7-11-23(22)30(24)19-8-4-3-5-9-19;1-2-3-15-29(25(31)20-16-18(26)13-14-21(20)27)17-24-28-22-11-7-8-12-23(22)30(24)19-9-5-4-6-10-19/h4-14,17,19,31H,15-16,18H2,1-3H3;4-8,10-15,17H,2-3,9,16,18H2,1H3;5-15,17H,3-4,16,18H2,1-2H3;4-15,18,30H,16-17H2,1-3H3;3-14,17H,15-16H2,1-2H3;4-14,16H,2-3,15,17H2,1H3
• InChIKey: RBUKPOWHOXNWEM-UHFFFAOYSA-N
• XLogP: 36.65
• TPSA: 296.93 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 23
• Rotatable Bonds: 44
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2675.76
LogP ≤ 5	36.65
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide?

The IUPAC name of N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide (CID 160581159) is N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide.

What is the SMILES notation for N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide?

The canonical SMILES for N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide is CC(C)CN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1Cl.CCCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1Cl.CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1cc(Cl)ccc1Cl.CCCCN(Cc1nc2ccccc2n1-c1ccccc1)C(=O)c1ccc(OC)c(F)c1.COc1ccc(C(=O)N(CCC(C)C)Cc2nc3ccccc3n2-c2ccccc2)cc1O.COc1ccc(C(=O)N(Cc2nc3ccccc3n2-c2ccccc2)CC(C)C)cc1O.

What is the InChIKey of N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide?

The InChIKey is RBUKPOWHOXNWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N3O3.C26H25Cl2N3O.C26H26FN3O2.C26H27N3O3.2C25H23Cl2N3O/c1-19(2)15-16-29(27(32)20-13-14-25(33-3)24(31)17-20)18-26-28-22-11-7-8-12-23(22)30(26)21-9-5-4-6-10-21;1-2-3-9-16-30(26(32)21-17-19(27)14-15-22(21)28)18-25-29-23-12-7-8-13-24(23)31(25)20-10-5-4-6-11-20;1-3-4-16-29(26(31)19-14-15-24(32-2)21(27)17-19)18-25-28-22-12-8-9-13-23(22)30(25)20-10-6-5-7-11-20;1-18(2)16-28(26(31)19-13-14-24(32-3)23(30)15-19)17-25-27-21-11-7-8-12-22(21)29(25)20-9-5-4-6-10-20;1-17(2)15-29(25(31)20-14-18(26)12-13-21(20)27)16-24-28-22-10-6-7-11-23(22)30(24)19-8-4-3-5-9-19;1-2-3-15-29(25(31)20-16-18(26)13-14-21(20)27)17-24-28-22-11-7-8-12-23(22)30(24)19-9-5-4-6-10-19/h4-14,17,19,31H,15-16,18H2,1-3H3;4-8,10-15,17H,2-3,9,16,18H2,1H3;5-15,17H,3-4,16,18H2,1-2H3;4-15,18,30H,16-17H2,1-3H3;3-14,17H,15-16H2,1-2H3;4-14,16H,2-3,15,17H2,1H3.

What are the key properties of N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide?

N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide has a molecular weight of 2675.76 g/mol, XLogP of 36.65, 44 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-butyl-2,5-dichloro-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;N-butyl-3-fluoro-4-methoxy-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;2,5-dichloro-N-pentyl-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(3-methylbutyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide;3-hydroxy-4-methoxy-N-(2-methylpropyl)-N-[(1-phenylbenzimidazol-2-yl)methyl]benzamide is sourced from PubChem (CID 160581159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).