2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole

C84H55Cl4F13N8O5 — CID 161014798

IUPAC2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole
SMILESCc1[nH]c(-c2ccc(-c3cc(C(F)(F)F)ccc3Cl)o2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)nc1-c1ccc(F)cc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(OC(F)(F)F)c3)o2)nc1-c1ccccc1
InChIInChI=1S/C21H13ClF4N2O.C21H14ClF3N2O2.2C21H14ClF3N2O/c1-11-19(12-2-5-14(23)6-3-12)28-20(27-11)18-9-8-17(29-18)13-4-7-16(22)15(10-13)21(24,25)26;1-12-19(13-5-3-2-4-6-13)27-20(26-12)17-10-9-16(28-17)14-7-8-15(22)18(11-14)29-21(23,24)25;1-12-19(13-5-3-2-4-6-13)27-20(26-12)18-10-9-17(28-18)15-11-14(21(23,24)25)7-8-16(15)22;1-12-19(13-5-3-2-4-6-13)27-20(26-12)18-10-9-17(28-18)14-7-8-16(22)15(11-14)21(23,24)25/h2-10H,1H3,(H,27,28);2-11H,1H3,(H,26,27);2*2-11H,1H3,(H,26,27)
InChIKeyTXOVJZVKKHUORL-UHFFFAOYSA-N
MW1645.20 g/mol
LogP27.96
Rot. Bonds13

About 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole

2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole (PubChem CID 161014798) has the molecular formula C84H55Cl4F13N8O5 and a molecular weight of 1645.20 g/mol. Its IUPAC name is 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole.

Molecular Properties

Compound Name2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole
PubChem CID161014798
Molecular FormulaC84H55Cl4F13N8O5
Molecular Weight1645.20 g/mol
Exact Mass1642.28
IUPAC Name2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole
SMILESCc1[nH]c(-c2ccc(-c3cc(C(F)(F)F)ccc3Cl)o2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)nc1-c1ccc(F)cc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(OC(F)(F)F)c3)o2)nc1-c1ccccc1
InChIInChI=1S/C21H13ClF4N2O.C21H14ClF3N2O2.2C21H14ClF3N2O/c1-11-19(12-2-5-14(23)6-3-12)28-20(27-11)18-9-8-17(29-18)13-4-7-16(22)15(10-13)21(24,25)26;1-12-19(13-5-3-2-4-6-13)27-20(26-12)17-10-9-16(28-17)14-7-8-15(22)18(11-14)29-21(23,24)25;1-12-19(13-5-3-2-4-6-13)27-20(26-12)18-10-9-17(28-18)15-11-14(21(23,24)25)7-8-16(15)22;1-12-19(13-5-3-2-4-6-13)27-20(26-12)18-10-9-17(28-18)14-7-8-16(22)15(11-14)21(23,24)25/h2-10H,1H3,(H,27,28);2-11H,1H3,(H,26,27);2*2-11H,1H3,(H,26,27)
InChIKeyTXOVJZVKKHUORL-UHFFFAOYSA-N
XLogP27.96
TPSA176.51 Ų
H-Bond Donors4
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms114
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001645.20
LogP ≤ 527.96
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 109

Analyze 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole?
The IUPAC name of 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole (CID 161014798) is 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole.
What is the SMILES notation for 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole?
The canonical SMILES for 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole is Cc1[nH]c(-c2ccc(-c3cc(C(F)(F)F)ccc3Cl)o2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)nc1-c1ccc(F)cc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)nc1-c1ccccc1.Cc1[nH]c(-c2ccc(-c3ccc(Cl)c(OC(F)(F)F)c3)o2)nc1-c1ccccc1.
What is the InChIKey of 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole?
The InChIKey is TXOVJZVKKHUORL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13ClF4N2O.C21H14ClF3N2O2.2C21H14ClF3N2O/c1-11-19(12-2-5-14(23)6-3-12)28-20(27-11)18-9-8-17(29-18)13-4-7-16(22)15(10-13)21(24,25)26;1-12-19(13-5-3-2-4-6-13)27-20(26-12)17-10-9-16(28-17)14-7-8-15(22)18(11-14)29-21(23,24)25;1-12-19(13-5-3-2-4-6-13)27-20(26-12)18-10-9-17(28-18)15-11-14(21(23,24)25)7-8-16(15)22;1-12-19(13-5-3-2-4-6-13)27-20(26-12)18-10-9-17(28-18)14-7-8-16(22)15(11-14)21(23,24)25/h2-10H,1H3,(H,27,28);2-11H,1H3,(H,26,27);2*2-11H,1H3,(H,26,27).
What are the key properties of 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole?
2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole has a molecular weight of 1645.20 g/mol, XLogP of 27.96, 13 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[4-chloro-3-(trifluoromethoxy)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-4-(4-fluorophenyl)-5-methyl-1H-imidazole;2-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole is sourced from PubChem (CID 161014798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).