2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid

C193H142F8N20O21 — CID 159471226

IUPAC2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid
SMILESCc1cc(C(=O)O)c2nc(-c3c(F)c(F)c(-c4ccccc4)c(F)c3F)n(C)c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(O)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(OCc5ccncc5)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(Oc5ccccc5C#N)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cccc(O)c4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cccc(OCc5ccccc5)c4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cnn(Cc5ccccc5)c4)cc3)[nH]c2c1.Cc1ccc(C)n1-c1c(F)c(F)c(C2=Nc3cccc(C(=O)O)c3C2)c(F)c1F
InChIInChI=1S/C28H19N3O3.C28H22N2O3.C27H21N3O3.C25H20N4O2.C22H14F4N2O2.C21H14F4N2O2.2C21H16N2O3/c1-17-14-23(28(32)33)26-24(15-17)30-27(31-26)20-8-6-18(7-9-20)19-10-12-22(13-11-19)34-25-5-3-2-4-21(25)16-29;1-18-14-24(28(31)32)26-25(15-18)29-27(30-26)21-12-10-20(11-13-21)22-8-5-9-23(16-22)33-17-19-6-3-2-4-7-19;1-17-14-23(27(31)32)25-24(15-17)29-26(30-25)21-4-2-19(3-5-21)20-6-8-22(9-7-20)33-16-18-10-12-28-13-11-18;1-16-11-21(25(30)31)23-22(12-16)27-24(28-23)19-9-7-18(8-10-19)20-13-26-29(15-20)14-17-5-3-2-4-6-17;1-10-8-12(22(29)30)20-13(9-10)28(2)21(27-20)15-18(25)16(23)14(17(24)19(15)26)11-6-4-3-5-7-11;1-9-6-7-10(2)27(9)20-18(24)16(22)15(17(23)19(20)25)14-8-12-11(21(28)29)4-3-5-13(12)26-14;1-12-10-17(21(25)26)19-18(11-12)22-20(23-19)15-4-2-13(3-5-15)14-6-8-16(24)9-7-14;1-12-9-17(21(25)26)19-18(10-12)22-20(23-19)14-7-5-13(6-8-14)15-3-2-4-16(24)11-15/h2-15H,1H3,(H,30,31)(H,32,33);2-16H,17H2,1H3,(H,29,30)(H,31,32);2-15H,16H2,1H3,(H,29,30)(H,31,32);2-13,15H,14H2,1H3,(H,27,28)(H,30,31);3-9H,1-2H3,(H,29,30);3-7H,8H2,1-2H3,(H,28,29);2*2-11,24H,1H3,(H,22,23)(H,25,26)
InChIKeyLVVHGCZLMVECRL-UHFFFAOYSA-N
MW3229.36 g/mol
LogP43.79
Rot. Bonds34

About 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid

2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid (PubChem CID 159471226) has the molecular formula C193H142F8N20O21 and a molecular weight of 3229.36 g/mol. Its IUPAC name is 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid.

Molecular Properties

Compound Name2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid
PubChem CID159471226
Molecular FormulaC193H142F8N20O21
Molecular Weight3229.36 g/mol
Exact Mass3227.05
IUPAC Name2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid
SMILESCc1cc(C(=O)O)c2nc(-c3c(F)c(F)c(-c4ccccc4)c(F)c3F)n(C)c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(O)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(OCc5ccncc5)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(Oc5ccccc5C#N)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cccc(O)c4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cccc(OCc5ccccc5)c4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cnn(Cc5ccccc5)c4)cc3)[nH]c2c1.Cc1ccc(C)n1-c1c(F)c(F)c(C2=Nc3cccc(C(=O)O)c3C2)c(F)c1F
InChIInChI=1S/C28H19N3O3.C28H22N2O3.C27H21N3O3.C25H20N4O2.C22H14F4N2O2.C21H14F4N2O2.2C21H16N2O3/c1-17-14-23(28(32)33)26-24(15-17)30-27(31-26)20-8-6-18(7-9-20)19-10-12-22(13-11-19)34-25-5-3-2-4-21(25)16-29;1-18-14-24(28(31)32)26-25(15-18)29-27(30-26)21-12-10-20(11-13-21)22-8-5-9-23(16-22)33-17-19-6-3-2-4-7-19;1-17-14-23(27(31)32)25-24(15-17)29-26(30-25)21-4-2-19(3-5-21)20-6-8-22(9-7-20)33-16-18-10-12-28-13-11-18;1-16-11-21(25(30)31)23-22(12-16)27-24(28-23)19-9-7-18(8-10-19)20-13-26-29(15-20)14-17-5-3-2-4-6-17;1-10-8-12(22(29)30)20-13(9-10)28(2)21(27-20)15-18(25)16(23)14(17(24)19(15)26)11-6-4-3-5-7-11;1-9-6-7-10(2)27(9)20-18(24)16(22)15(17(23)19(20)25)14-8-12-11(21(28)29)4-3-5-13(12)26-14;1-12-10-17(21(25)26)19-18(11-12)22-20(23-19)15-4-2-13(3-5-15)14-6-8-16(24)9-7-14;1-12-9-17(21(25)26)19-18(10-12)22-20(23-19)14-7-5-13(6-8-14)15-3-2-4-16(24)11-15/h2-15H,1H3,(H,30,31)(H,32,33);2-16H,17H2,1H3,(H,29,30)(H,31,32);2-15H,16H2,1H3,(H,29,30)(H,31,32);2-13,15H,14H2,1H3,(H,27,28)(H,30,31);3-9H,1-2H3,(H,29,30);3-7H,8H2,1-2H3,(H,28,29);2*2-11,24H,1H3,(H,22,23)(H,25,26)
InChIKeyLVVHGCZLMVECRL-UHFFFAOYSA-N
XLogP43.79
TPSA628.24 Ų
H-Bond Donors16
H-Bond Acceptors27
Rotatable Bonds34
Heavy Atoms242
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003229.36
LogP ≤ 543.79
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'pyrrole_A(118)', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(2-fluorophenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;2-[4-(3-methoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;2-[4-(4-methylphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-(4-phenylphenyl)-1H-benzimidazole-4-carboxylic acid;2-(3-phenoxyphenyl)-1H-benzimidazole-4-carboxylic acid;2-(4-phenoxyphenyl)-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(trifluoromethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(trifluoromethyl)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid
CID 158328827
5-[4-[(4S)-4-[(5-fluoro-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]phenyl]-1-methylpyrazole-3-carbaldehyde;(5R)-5-[(5-fluoro-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(7-methyl-3H-benzimidazol-5-yl)phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-fluoro-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-[6-(trifluoromethyl)-1H-benzimidazol-4-yl]phenyl]imidazolidine-2,4-dione;(5R)-5-[[5-(4-hydroxybut-2-ynoxy)-3-oxo-1H-isoindol-2-yl]methyl]-5-(4-quinolin-8-ylphenyl)imidazolidine-2,4-dione
CID 158620082
2-[4-(3,4-difluorophenyl)-2,3,5,6-tetrafluorophenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(3,5-difluorophenyl)-2,3,5,6-tetrafluorophenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(4-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-(4-pyrazin-2-ylphenyl)-1H-benzimidazole-4-carboxylic acid;6-methyl-2-(4-thiophen-2-ylphenyl)-1H-benzimidazole-4-carboxylic acid;2-(2,3,5,6-tetrafluoro-4-thiophen-3-ylphenyl)-1H-benzimidazole-4-carboxylic acid;2-[2,3,5,6-tetrafluoro-4-[3-(trifluoromethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid
CID 159379483
(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(5-methyl-1-phenylpyrazol-4-yl)phenyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-[1-propan-2-yl-6-(trifluoromethyl)benzimidazol-4-yl]phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-[6-(trifluoromethyl)-1H-benzimidazol-4-yl]phenyl]imidazolidine-2,4-dione
CID 160249998
tert-butyl 3-(1-methyl-3-propan-2-ylindol-5-yl)propanoate;3-(1,1-difluoroethyl)-4,4-difluoro-1-propan-2-yl-5,6-dihydrocyclopenta[c]pyrazole;5,7-difluoro-3-propan-2-yl-1H-indole;1,6-dimethyl-5-phenylmethoxy-3-propan-2-ylindole;1,2-di(propan-2-yl)imidazole;4-methyl-3-propan-2-yl-1H-indole;1-propan-2-yl-3,5-bis(trifluoromethyl)pyrazole;1-(1-propan-2-ylindol-3-yl)ethanone;1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol;3-propan-2-yl-6-(trifluoromethyl)-1H-indole;1,3,5-tri(propan-2-yl)pyrazole
CID 160638966
tert-butyl 3-(1-methyl-3-propan-2-ylindol-5-yl)propanoate;3-(1,1-difluoroethyl)-4,4-difluoro-1-propan-2-yl-5,6-dihydrocyclopenta[c]pyrazole;5,7-difluoro-3-propan-2-yl-1H-indole;1,6-dimethylpyrrolo[3,2-c]pyridine;methyl 1,5-di(propan-2-yl)pyrazole-3-carboxylate;N-methyl-1-(4-methyl-1-propan-2-ylbenzimidazol-2-yl)ethenamine;6-methyl-5-phenylmethoxy-3-propan-2-yl-1H-indole;4-methyl-3-propan-2-yl-1H-indole;1-methyl-3-propan-2-yl-6-(trifluoromethyl)indole;1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-ol
CID 160714457
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxynaphthalene-1-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-(3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]benzamide;2,6-difluoro-N-[5-[6-(4-propan-2-ylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 160851026
(5R)-5-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-(5-methyl-1-phenylpyrazol-4-yl)phenyl]imidazolidine-2,4-dione;(5S)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]phenyl]imidazolidine-2,4-dione;(5R)-5-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-5-[4-[6-(trifluoromethyl)-1H-benzimidazol-4-yl]phenyl]imidazolidine-2,4-dione
CID 160868295
2-[4-(3,4-difluorophenyl)-2,3,5,6-tetrafluorophenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(3,5-difluorophenyl)-2,3,5,6-tetrafluorophenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-formylphenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(4-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-(4-pyrazin-2-ylphenyl)-1H-benzimidazole-4-carboxylic acid;6-methyl-2-(4-thiophen-2-ylphenyl)-1H-benzimidazole-4-carboxylic acid;2-(2,3,5,6-tetrafluoro-4-thiophen-3-ylphenyl)-1H-benzimidazole-4-carboxylic acid;2-[2,3,5,6-tetrafluoro-4-[3-(trifluoromethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid
CID 161393804
N-(1H-benzimidazol-4-ylmethyl)-3-ethoxy-N-methyl-4-(1H-pyrazol-5-yl)benzamide;3-(2,2-difluoroethoxy)-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide;3-(difluoromethoxy)-4-(3-fluorophenyl)-N-(3H-isoindol-4-ylmethyl)-N-methylbenzamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(2,2,2-trifluoroethyl)benzamide;3-(fluoromethoxy)-4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylbenzamide;N-(1H-indazol-7-ylmethyl)-3-(methoxymethyl)-N-methyl-4-phenylbenzamide
CID 167555498
[2-[[4-[6-[(4-Cyano-2-fluorophenyl)methoxy]-2-pyridinyl]-2,5-difluorophenyl]methyl]-3-(2-methoxyethyl)-7-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzimidazole-5-carbonyl] 2-[[4-[6-[(4-cyano-2-fluorophenyl)methoxy]-2-pyridinyl]-2,5-difluorophenyl]methyl]-3-(2-methoxyethyl)-7-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzimidazole-5-carboxylate
CID 170322983
2-[4-[4-[4-[2-[[4-[4-(4-carboxy-6-methyl-1H-benzimidazol-2-yl)phenyl]pyrazol-1-yl]methyl]phenyl]-2-cyanophenoxy]phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid
CID 91380779

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid?
The IUPAC name of 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid (CID 159471226) is 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid.
What is the SMILES notation for 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid?
The canonical SMILES for 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid is Cc1cc(C(=O)O)c2nc(-c3c(F)c(F)c(-c4ccccc4)c(F)c3F)n(C)c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(O)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(OCc5ccncc5)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4ccc(Oc5ccccc5C#N)cc4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cccc(O)c4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cccc(OCc5ccccc5)c4)cc3)[nH]c2c1.Cc1cc(C(=O)O)c2nc(-c3ccc(-c4cnn(Cc5ccccc5)c4)cc3)[nH]c2c1.Cc1ccc(C)n1-c1c(F)c(F)c(C2=Nc3cccc(C(=O)O)c3C2)c(F)c1F.
What is the InChIKey of 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid?
The InChIKey is LVVHGCZLMVECRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H19N3O3.C28H22N2O3.C27H21N3O3.C25H20N4O2.C22H14F4N2O2.C21H14F4N2O2.2C21H16N2O3/c1-17-14-23(28(32)33)26-24(15-17)30-27(31-26)20-8-6-18(7-9-20)19-10-12-22(13-11-19)34-25-5-3-2-4-21(25)16-29;1-18-14-24(28(31)32)26-25(15-18)29-27(30-26)21-12-10-20(11-13-21)22-8-5-9-23(16-22)33-17-19-6-3-2-4-7-19;1-17-14-23(27(31)32)25-24(15-17)29-26(30-25)21-4-2-19(3-5-21)20-6-8-22(9-7-20)33-16-18-10-12-28-13-11-18;1-16-11-21(25(30)31)23-22(12-16)27-24(28-23)19-9-7-18(8-10-19)20-13-26-29(15-20)14-17-5-3-2-4-6-17;1-10-8-12(22(29)30)20-13(9-10)28(2)21(27-20)15-18(25)16(23)14(17(24)19(15)26)11-6-4-3-5-7-11;1-9-6-7-10(2)27(9)20-18(24)16(22)15(17(23)19(20)25)14-8-12-11(21(28)29)4-3-5-13(12)26-14;1-12-10-17(21(25)26)19-18(11-12)22-20(23-19)15-4-2-13(3-5-15)14-6-8-16(24)9-7-14;1-12-9-17(21(25)26)19-18(10-12)22-20(23-19)14-7-5-13(6-8-14)15-3-2-4-16(24)11-15/h2-15H,1H3,(H,30,31)(H,32,33);2-16H,17H2,1H3,(H,29,30)(H,31,32);2-15H,16H2,1H3,(H,29,30)(H,31,32);2-13,15H,14H2,1H3,(H,27,28)(H,30,31);3-9H,1-2H3,(H,29,30);3-7H,8H2,1-2H3,(H,28,29);2*2-11,24H,1H3,(H,22,23)(H,25,26).
What are the key properties of 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid?
2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid has a molecular weight of 3229.36 g/mol, XLogP of 43.79, 34 rotatable bonds, 16 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-benzylpyrazol-4-yl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(2-cyanophenoxy)phenyl]phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(2,5-dimethylpyrrol-1-yl)-2,3,5,6-tetrafluorophenyl]-3H-indole-4-carboxylic acid;1,6-dimethyl-2-(2,3,5,6-tetrafluoro-4-phenylphenyl)benzimidazole-4-carboxylic acid;2-[4-(3-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;2-[4-(4-hydroxyphenyl)phenyl]-6-methyl-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-(3-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;6-methyl-2-[4-[4-(pyridin-4-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid is sourced from PubChem (CID 159471226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).