2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol

C144H96Cl3F27N32O9 — CID 161152664

IUPAC2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol
SMILESCOc1cc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc(CO)c1CO.COc1cc(CO)cc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)c1.COc1cc(CO)ccc1-c1cc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)[nH]n1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc(Cl)c(Cl)c4)n[nH]3)[nH]c2c1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc(Cl)cc4)n[nH]3)[nH]c2c1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc5c(c4)OCO5)n[nH]3)[nH]c2c1.Fc1ccc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc1.Fc1ccc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc1F
InChIInChI=1S/C20H17F3N4O3.2C19H15F3N4O2.C18H11F3N4O2.C17H9Cl2F3N4.C17H10ClF3N4.C17H9F5N4.C17H10F4N4/c1-30-18-5-10(4-11(8-28)13(18)9-29)15-7-17(27-26-15)19-24-14-3-2-12(20(21,22)23)6-16(14)25-19;1-28-17-6-10(9-27)2-4-12(17)14-8-16(26-25-14)18-23-13-5-3-11(19(20,21)22)7-15(13)24-18;1-28-13-5-10(9-27)4-11(6-13)15-8-17(26-25-15)18-23-14-3-2-12(19(20,21)22)7-16(14)24-18;19-18(20,21)10-2-3-11-13(6-10)23-17(22-11)14-7-12(24-25-14)9-1-4-15-16(5-9)27-8-26-15;18-10-3-1-8(5-11(10)19)13-7-15(26-25-13)16-23-12-4-2-9(17(20,21)22)6-14(12)24-16;18-11-4-1-9(2-5-11)13-8-15(25-24-13)16-22-12-6-3-10(17(19,20)21)7-14(12)23-16;18-10-3-1-8(5-11(10)19)13-7-15(26-25-13)16-23-12-4-2-9(17(20,21)22)6-14(12)24-16;18-11-4-1-9(2-5-11)13-8-15(25-24-13)16-22-12-6-3-10(17(19,20)21)7-14(12)23-16/h2-7,28-29H,8-9H2,1H3,(H,24,25)(H,26,27);2*2-8,27H,9H2,1H3,(H,23,24)(H,25,26);1-7H,8H2,(H,22,23)(H,24,25);1-7H,(H,23,24)(H,25,26);1-8H,(H,22,23)(H,24,25);1-7H,(H,23,24)(H,25,26);1-8H,(H,22,23)(H,24,25)
InChIKeyUOWSGBPTOWHCRL-UHFFFAOYSA-N
MW3037.87 g/mol
LogP37.21
Rot. Bonds23

About 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol

2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol (PubChem CID 161152664) has the molecular formula C144H96Cl3F27N32O9 and a molecular weight of 3037.87 g/mol. Its IUPAC name is 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol.

Molecular Properties

Compound Name2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol
PubChem CID161152664
Molecular FormulaC144H96Cl3F27N32O9
Molecular Weight3037.87 g/mol
Exact Mass3034.67
IUPAC Name2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol
SMILESCOc1cc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc(CO)c1CO.COc1cc(CO)cc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)c1.COc1cc(CO)ccc1-c1cc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)[nH]n1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc(Cl)c(Cl)c4)n[nH]3)[nH]c2c1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc(Cl)cc4)n[nH]3)[nH]c2c1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc5c(c4)OCO5)n[nH]3)[nH]c2c1.Fc1ccc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc1.Fc1ccc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc1F
InChIInChI=1S/C20H17F3N4O3.2C19H15F3N4O2.C18H11F3N4O2.C17H9Cl2F3N4.C17H10ClF3N4.C17H9F5N4.C17H10F4N4/c1-30-18-5-10(4-11(8-28)13(18)9-29)15-7-17(27-26-15)19-24-14-3-2-12(20(21,22)23)6-16(14)25-19;1-28-17-6-10(9-27)2-4-12(17)14-8-16(26-25-14)18-23-13-5-3-11(19(20,21)22)7-15(13)24-18;1-28-13-5-10(9-27)4-11(6-13)15-8-17(26-25-15)18-23-14-3-2-12(19(20,21)22)7-16(14)24-18;19-18(20,21)10-2-3-11-13(6-10)23-17(22-11)14-7-12(24-25-14)9-1-4-15-16(5-9)27-8-26-15;18-10-3-1-8(5-11(10)19)13-7-15(26-25-13)16-23-12-4-2-9(17(20,21)22)6-14(12)24-16;18-11-4-1-9(2-5-11)13-8-15(25-24-13)16-22-12-6-3-10(17(19,20)21)7-14(12)23-16;18-10-3-1-8(5-11(10)19)13-7-15(26-25-13)16-23-12-4-2-9(17(20,21)22)6-14(12)24-16;18-11-4-1-9(2-5-11)13-8-15(25-24-13)16-22-12-6-3-10(17(19,20)21)7-14(12)23-16/h2-7,28-29H,8-9H2,1H3,(H,24,25)(H,26,27);2*2-8,27H,9H2,1H3,(H,23,24)(H,25,26);1-7H,8H2,(H,22,23)(H,24,25);1-7H,(H,23,24)(H,25,26);1-8H,(H,22,23)(H,24,25);1-7H,(H,23,24)(H,25,26);1-8H,(H,22,23)(H,24,25)
InChIKeyUOWSGBPTOWHCRL-UHFFFAOYSA-N
XLogP37.21
TPSA585.95 Ų
H-Bond Donors20
H-Bond Acceptors25
Rotatable Bonds23
Heavy Atoms215
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003037.87
LogP ≤ 537.21
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1025

Analyze 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol with MolForge

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Related Compounds

2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-5-bromo-6-(trifluoromethyl)-1H-benzimidazole;5-bromo-2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;5-bromo-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[5-[5-[5-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]-2-(hydroxymethyl)-3-methoxyphenyl]methanol;[4-[5-[5-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]-2-(hydroxymethyl)phenyl]methanol;[3-[5-[5-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]-5-methoxyphenyl]methanol;[4-[5-[5-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]-3-methoxyphenyl]methanol;[4-[5-[5-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol
CID 161714171
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;[3-fluoro-4-[5-(6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;6-methyl-2-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole
CID 158080451
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-5-fluoro-6-methyl-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-5-fluoro-6-methyl-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-5-fluoro-6-methyl-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-5-fluoro-6-methyl-1H-benzimidazole;2-[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-5-fluoro-6-methyl-1H-benzimidazole;[3-fluoro-4-[5-(5-fluoro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;5-fluoro-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;5-fluoro-6-methyl-2-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole
CID 158084500
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-chloro-1H-benzimidazole;[4-[5-(6-chloro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-3-fluorophenyl]methanol;[5-[5-(6-chloro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)-3-methoxyphenyl]methanol;6-chloro-2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;6-chloro-2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;6-chloro-2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;6-chloro-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;6-chloro-2-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole
CID 158100630
[4-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-3-fluorophenyl]methanol;2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;2-[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;2-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole
CID 158215885
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;2-[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;[3-fluoro-4-[5-(6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;6-methyl-2-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole
CID 158393909
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-5-bromo-6-methyl-1H-benzimidazole;5-bromo-2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;5-bromo-2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;5-bromo-2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;5-bromo-2-[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;5-bromo-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methyl-1H-benzimidazole;[4-[5-(5-bromo-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-3-fluorophenyl]methanol;5-bromo-6-methyl-2-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole
CID 158458233
[5-[5-(5-fluoro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)-3-methoxyphenyl]methanol;[4-[5-(5-fluoro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)phenyl]methanol;[3-[5-(5-fluoro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-5-methoxyphenyl]methanol;[4-[5-(5-fluoro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-3-methoxyphenyl]methanol;[4-[5-(5-fluoro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;5-fluoro-6-methyl-2-(3-phenyl-1H-pyrazol-5-yl)-1H-benzimidazole
CID 158696379
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-5-chloro-6-fluoro-1H-benzimidazole;[5-[5-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)-3-methoxyphenyl]methanol;[4-[5-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)phenyl]methanol;[3-[5-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-5-methoxyphenyl]methanol;[4-[5-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-3-methoxyphenyl]methanol;[4-[5-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;5-chloro-6-fluoro-2-(3-phenyl-1H-pyrazol-5-yl)-1H-benzimidazole;2-[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-6-nitro-1H-benzimidazole
CID 158989313
[5-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)-3-methoxyphenyl]methanol;[4-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)phenyl]methanol;[3-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-5-methoxyphenyl]methanol;[4-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-3-methoxyphenyl]methanol;[4-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;2-(3-phenyl-1H-pyrazol-5-yl)-1H-benzimidazole
CID 158997077
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-5,6-dichloro-1H-benzimidazole;[5-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)-3-methoxyphenyl]methanol;[4-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-2-(hydroxymethyl)phenyl]methanol;[3-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-5-methoxyphenyl]methanol;[4-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]-3-methoxyphenyl]methanol;[4-[5-(5,6-dichloro-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;5,6-dichloro-2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;5,6-dichloro-2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1H-benzimidazole
CID 159065002
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-methoxy-1H-benzimidazole;6-chloro-2-[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-1H-benzimidazole;[2-(hydroxymethyl)-4-[5-(6-methoxy-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;[2-(hydroxymethyl)-3-methoxy-5-[5-(6-methoxy-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;[4-[5-(6-methoxy-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-(6-methoxy-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-(6-methoxy-1H-benzimidazol-2-yl)-1H-pyrazol-3-yl]phenyl]methanol;6-methoxy-2-(3-phenyl-1H-pyrazol-5-yl)-1H-benzimidazole
CID 159456125

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol?
The IUPAC name of 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol (CID 161152664) is 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol.
What is the SMILES notation for 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol?
The canonical SMILES for 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol is COc1cc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc(CO)c1CO.COc1cc(CO)cc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)c1.COc1cc(CO)ccc1-c1cc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)[nH]n1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc(Cl)c(Cl)c4)n[nH]3)[nH]c2c1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc(Cl)cc4)n[nH]3)[nH]c2c1.FC(F)(F)c1ccc2nc(-c3cc(-c4ccc5c(c4)OCO5)n[nH]3)[nH]c2c1.Fc1ccc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc1.Fc1ccc(-c2cc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)[nH]n2)cc1F.
What is the InChIKey of 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol?
The InChIKey is UOWSGBPTOWHCRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F3N4O3.2C19H15F3N4O2.C18H11F3N4O2.C17H9Cl2F3N4.C17H10ClF3N4.C17H9F5N4.C17H10F4N4/c1-30-18-5-10(4-11(8-28)13(18)9-29)15-7-17(27-26-15)19-24-14-3-2-12(20(21,22)23)6-16(14)25-19;1-28-17-6-10(9-27)2-4-12(17)14-8-16(26-25-14)18-23-13-5-3-11(19(20,21)22)7-15(13)24-18;1-28-13-5-10(9-27)4-11(6-13)15-8-17(26-25-15)18-23-14-3-2-12(19(20,21)22)7-16(14)24-18;19-18(20,21)10-2-3-11-13(6-10)23-17(22-11)14-7-12(24-25-14)9-1-4-15-16(5-9)27-8-26-15;18-10-3-1-8(5-11(10)19)13-7-15(26-25-13)16-23-12-4-2-9(17(20,21)22)6-14(12)24-16;18-11-4-1-9(2-5-11)13-8-15(25-24-13)16-22-12-6-3-10(17(19,20)21)7-14(12)23-16;18-10-3-1-8(5-11(10)19)13-7-15(26-25-13)16-23-12-4-2-9(17(20,21)22)6-14(12)24-16;18-11-4-1-9(2-5-11)13-8-15(25-24-13)16-22-12-6-3-10(17(19,20)21)7-14(12)23-16/h2-7,28-29H,8-9H2,1H3,(H,24,25)(H,26,27);2*2-8,27H,9H2,1H3,(H,23,24)(H,25,26);1-7H,8H2,(H,22,23)(H,24,25);1-7H,(H,23,24)(H,25,26);1-8H,(H,22,23)(H,24,25);1-7H,(H,23,24)(H,25,26);1-8H,(H,22,23)(H,24,25).
What are the key properties of 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol?
2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol has a molecular weight of 3037.87 g/mol, XLogP of 37.21, 23 rotatable bonds, 20 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(3,4-difluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-(trifluoromethyl)-1H-benzimidazole;[2-(hydroxymethyl)-3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-4-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol;[3-methoxy-5-[5-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-3-yl]phenyl]methanol is sourced from PubChem (CID 161152664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).