4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide

C188H143Br2Cl6F18N21O7 — CID 158813730

About 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide

4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide (PubChem CID 158813730) has the molecular formula C188H143Br2Cl6F18N21O7 and a molecular weight of 3522.84 g/mol. Its IUPAC name is 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide.

Molecular Properties

• Compound Name: 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide
• PubChem CID: 158813730
• Molecular Formula: C188H143Br2Cl6F18N21O7
• Molecular Weight: 3522.84 g/mol
• Exact Mass: 3515.77
• IUPAC Name: 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide
• SMILES: Cc1cccc(-c2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)n2Cc2ccc(C(N)=O)cc2)c1.NC(=O)c1ccc(Cn2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccc(Cl)cc3)c2-c2ccc(Cl)cc2)cc1.NC(=O)c1ccc(Cn2c(-c3ccc(C(F)(F)F)cc3C(F)(F)F)nc(-c3ccc(Cl)cc3)c2-c2ccc(Cl)cc2)cc1.[H]/N=C(\N)c1ccc(Cn2c(-c3cc(C)cc(C(F)(F)F)c3)nc(-c3ccc(Br)cc3)c2-c2ccc(Br)cc2)cc1.[H]/N=C(\N)c1ccc(Cn2c(-c3cc(C)cc(C(F)(F)F)c3)nc(-c3ccc(CO)cc3)c2-c2ccc(OC)cc2)cc1.[H]/N=C(\N)c1ccc(Cn2c(-c3cc(C)cc(C(F)(F)F)c3)nc(-c3cccc(OC)c3)c2-c2cccc(OC)c2)cc1
• InChI: InChI=1S/2C33H29F3N4O2.C31H23Br2F3N4.C31H19Cl2F6N3O.C30H20Cl2F3N3O.C30H23Cl2N3O/c1-20-15-26(17-27(16-20)33(34,35)36)32-39-29(23-7-5-22(19-41)6-8-23)30(24-11-13-28(42-2)14-12-24)40(32)18-21-3-9-25(10-4-21)31(37)38;1-20-14-25(16-26(15-20)33(34,35)36)32-39-29(23-6-4-8-27(17-23)41-2)30(24-7-5-9-28(18-24)42-3)40(32)19-21-10-12-22(13-11-21)31(37)38;1-18-14-23(16-24(15-18)31(34,35)36)30-39-27(20-6-10-25(32)11-7-20)28(21-8-12-26(33)13-9-21)40(30)17-19-2-4-22(5-3-19)29(37)38;32-22-10-5-18(6-11-22)26-27(19-7-12-23(33)13-8-19)42(16-17-1-3-20(4-2-17)28(40)43)29(41-26)24-14-9-21(30(34,35)36)15-25(24)31(37,38)39;31-24-13-7-19(8-14-24)26-27(20-9-15-25(32)16-10-20)38(17-18-1-3-21(4-2-18)28(36)39)29(37-26)22-5-11-23(12-6-22)30(33,34)35;1-19-3-2-4-24(17-19)30-34-27(21-9-13-25(31)14-10-21)28(22-11-15-26(32)16-12-22)35(30)18-20-5-7-23(8-6-20)29(33)36/h3-17,41H,18-19H2,1-2H3,(H3,37,38);4-18H,19H2,1-3H3,(H3,37,38);2-16H,17H2,1H3,(H3,37,38);1-15H,16H2,(H2,40,43);1-16H,17H2,(H2,36,39);2-17H,18H2,1H3,(H2,33,36)
• InChIKey: IUZUSFZMYKXQGI-UHFFFAOYSA-N
• XLogP: 49.05
• TPSA: 433.72 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 22
• Rotatable Bonds: 40
• Heavy Atoms: 242
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3522.84
LogP ≤ 5	49.05
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	22

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 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide?

The IUPAC name of 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide (CID 158813730) is 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide.

What is the SMILES notation for 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide?

The canonical SMILES for 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide is Cc1cccc(-c2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)n2Cc2ccc(C(N)=O)cc2)c1.NC(=O)c1ccc(Cn2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccc(Cl)cc3)c2-c2ccc(Cl)cc2)cc1.NC(=O)c1ccc(Cn2c(-c3ccc(C(F)(F)F)cc3C(F)(F)F)nc(-c3ccc(Cl)cc3)c2-c2ccc(Cl)cc2)cc1.[H]/N=C(\N)c1ccc(Cn2c(-c3cc(C)cc(C(F)(F)F)c3)nc(-c3ccc(Br)cc3)c2-c2ccc(Br)cc2)cc1.[H]/N=C(\N)c1ccc(Cn2c(-c3cc(C)cc(C(F)(F)F)c3)nc(-c3ccc(CO)cc3)c2-c2ccc(OC)cc2)cc1.[H]/N=C(\N)c1ccc(Cn2c(-c3cc(C)cc(C(F)(F)F)c3)nc(-c3cccc(OC)c3)c2-c2cccc(OC)c2)cc1.

What is the InChIKey of 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide?

The InChIKey is IUZUSFZMYKXQGI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C33H29F3N4O2.C31H23Br2F3N4.C31H19Cl2F6N3O.C30H20Cl2F3N3O.C30H23Cl2N3O/c1-20-15-26(17-27(16-20)33(34,35)36)32-39-29(23-7-5-22(19-41)6-8-23)30(24-11-13-28(42-2)14-12-24)40(32)18-21-3-9-25(10-4-21)31(37)38;1-20-14-25(16-26(15-20)33(34,35)36)32-39-29(23-6-4-8-27(17-23)41-2)30(24-7-5-9-28(18-24)42-3)40(32)19-21-10-12-22(13-11-21)31(37)38;1-18-14-23(16-24(15-18)31(34,35)36)30-39-27(20-6-10-25(32)11-7-20)28(21-8-12-26(33)13-9-21)40(30)17-19-2-4-22(5-3-19)29(37)38;32-22-10-5-18(6-11-22)26-27(19-7-12-23(33)13-8-19)42(16-17-1-3-20(4-2-17)28(40)43)29(41-26)24-14-9-21(30(34,35)36)15-25(24)31(37,38)39;31-24-13-7-19(8-14-24)26-27(20-9-15-25(32)16-10-20)38(17-18-1-3-21(4-2-18)28(36)39)29(37-26)22-5-11-23(12-6-22)30(33,34)35;1-19-3-2-4-24(17-19)30-34-27(21-9-13-25(31)14-10-21)28(22-11-15-26(32)16-12-22)35(30)18-20-5-7-23(8-6-20)29(33)36/h3-17,41H,18-19H2,1-2H3,(H3,37,38);4-18H,19H2,1-3H3,(H3,37,38);2-16H,17H2,1H3,(H3,37,38);1-15H,16H2,(H2,40,43);1-16H,17H2,(H2,36,39);2-17H,18H2,1H3,(H2,33,36).

What are the key properties of 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide?

4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide has a molecular weight of 3522.84 g/mol, XLogP of 49.05, 40 rotatable bonds, 10 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[4,5-bis(4-bromophenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[4,5-bis(4-chlorophenyl)-2-(3-methylphenyl)imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(4-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzamide;4-[[4,5-bis(3-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide;4-[[2-[2,4-bis(trifluoromethyl)phenyl]-4,5-bis(4-chlorophenyl)imidazol-1-yl]methyl]benzamide;4-[[4-[4-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-2-[3-methyl-5-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]benzenecarboximidamide is sourced from PubChem (CID 158813730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).