2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone

C294H257Cl2N39O17 — CID 158290943

IUPAC2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone
SMILESCN(C)c1ccc(-c2nc3ccc(CC(=O)c4ccc5[nH]ccc5c4)cc3[nH]2)cc1.CN(C)c1ccc(-c2nc3ccc(CC(=O)c4cccc(Cl)c4)cc3[nH]2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc(Cc5ccccc5)cc4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5c(c4)C=CC5)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5c(ccn5C)c4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5ccn(C)c5c4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4cccc(N(C)C)c4)[nH]c3c2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4ccc(-n5cccc5)cc4)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4ccc(C(=O)NN)cc4)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4cccc(Cl)c4)cc3[nH]2)cc1.COc1ccc(C(=O)Cc2ccc3nc(-c4ccccc4)[nH]c3c2)cc1.O=C(Cc1ccc2nc(-c3ccccc3)[nH]c2c1)c1ccncc1
InChIInChI=1S/C30H27N3O.2C26H24N4O.C26H21N3O2.C26H23N3O.C25H22N4O.C25H26N4O.C23H20ClN3O.C23H20N4O3.C22H17ClN2O2.C22H18N2O2.C20H15N3O/c1-33(2)26-15-13-24(14-16-26)29(34)20-23-10-17-27-28(19-23)32-30(31-27)25-11-8-22(9-12-25)18-21-6-4-3-5-7-21;1-29(2)21-8-5-18(6-9-21)25(31)15-17-4-10-22-23(14-17)28-26(27-22)20-7-11-24-19(16-20)12-13-30(24)3;1-29(2)21-9-7-19(8-10-21)25(31)15-17-4-11-22-23(14-17)28-26(27-22)20-6-5-18-12-13-30(3)24(18)16-20;1-31-22-11-7-20(8-12-22)26-27-23-13-4-18(16-24(23)28-26)17-25(30)19-5-9-21(10-6-19)29-14-2-3-15-29;1-29(2)22-11-9-19(10-12-22)25(30)15-17-6-13-23-24(14-17)28-26(27-23)21-8-7-18-4-3-5-20(18)16-21;1-29(2)20-7-4-17(5-8-20)25-27-22-9-3-16(13-23(22)28-25)14-24(30)19-6-10-21-18(15-19)11-12-26-21;1-28(2)20-11-9-18(10-12-20)24(30)15-17-8-13-22-23(14-17)27-25(26-22)19-6-5-7-21(16-19)29(3)4;1-27(2)19-9-7-16(8-10-19)23-25-20-11-6-15(12-21(20)26-23)13-22(28)17-4-3-5-18(24)14-17;1-30-18-9-7-16(8-10-18)22-25-19-11-2-14(12-20(19)26-22)13-21(28)15-3-5-17(6-4-15)23(29)27-24;1-27-18-8-6-15(7-9-18)22-24-19-10-5-14(11-20(19)25-22)12-21(26)16-3-2-4-17(23)13-16;1-26-18-10-8-16(9-11-18)21(25)14-15-7-12-19-20(13-15)24-22(23-19)17-5-3-2-4-6-17;24-19(15-8-10-21-11-9-15)13-14-6-7-17-18(12-14)23-20(22-17)16-4-2-1-3-5-16/h3-17,19H,18,20H2,1-2H3,(H,31,32);2*4-14,16H,15H2,1-3H3,(H,27,28);2-16H,17H2,1H3,(H,27,28);3,5-14,16H,4,15H2,1-2H3,(H,27,28);3-13,15,26H,14H2,1-2H3,(H,27,28);5-14,16H,15H2,1-4H3,(H,26,27);3-12,14H,13H2,1-2H3,(H,25,26);2-12H,13,24H2,1H3,(H,25,26)(H,27,29);2-11,13H,12H2,1H3,(H,24,25);2-13H,14H2,1H3,(H,23,24);1-12H,13H2,(H,22,23)
InChIKeyGLIPQXXINABUHQ-UHFFFAOYSA-N
MW4679.45 g/mol
LogP60.15
Rot. Bonds64

About 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone

2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone (PubChem CID 158290943) has the molecular formula C294H257Cl2N39O17 and a molecular weight of 4679.45 g/mol. Its IUPAC name is 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone.

Molecular Properties

Compound Name2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone
PubChem CID158290943
Molecular FormulaC294H257Cl2N39O17
Molecular Weight4679.45 g/mol
Exact Mass4674.98
IUPAC Name2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone
SMILESCN(C)c1ccc(-c2nc3ccc(CC(=O)c4ccc5[nH]ccc5c4)cc3[nH]2)cc1.CN(C)c1ccc(-c2nc3ccc(CC(=O)c4cccc(Cl)c4)cc3[nH]2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc(Cc5ccccc5)cc4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5c(c4)C=CC5)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5c(ccn5C)c4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5ccn(C)c5c4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4cccc(N(C)C)c4)[nH]c3c2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4ccc(-n5cccc5)cc4)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4ccc(C(=O)NN)cc4)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4cccc(Cl)c4)cc3[nH]2)cc1.COc1ccc(C(=O)Cc2ccc3nc(-c4ccccc4)[nH]c3c2)cc1.O=C(Cc1ccc2nc(-c3ccccc3)[nH]c2c1)c1ccncc1
InChIInChI=1S/C30H27N3O.2C26H24N4O.C26H21N3O2.C26H23N3O.C25H22N4O.C25H26N4O.C23H20ClN3O.C23H20N4O3.C22H17ClN2O2.C22H18N2O2.C20H15N3O/c1-33(2)26-15-13-24(14-16-26)29(34)20-23-10-17-27-28(19-23)32-30(31-27)25-11-8-22(9-12-25)18-21-6-4-3-5-7-21;1-29(2)21-8-5-18(6-9-21)25(31)15-17-4-10-22-23(14-17)28-26(27-22)20-7-11-24-19(16-20)12-13-30(24)3;1-29(2)21-9-7-19(8-10-21)25(31)15-17-4-11-22-23(14-17)28-26(27-22)20-6-5-18-12-13-30(3)24(18)16-20;1-31-22-11-7-20(8-12-22)26-27-23-13-4-18(16-24(23)28-26)17-25(30)19-5-9-21(10-6-19)29-14-2-3-15-29;1-29(2)22-11-9-19(10-12-22)25(30)15-17-6-13-23-24(14-17)28-26(27-23)21-8-7-18-4-3-5-20(18)16-21;1-29(2)20-7-4-17(5-8-20)25-27-22-9-3-16(13-23(22)28-25)14-24(30)19-6-10-21-18(15-19)11-12-26-21;1-28(2)20-11-9-18(10-12-20)24(30)15-17-8-13-22-23(14-17)27-25(26-22)19-6-5-7-21(16-19)29(3)4;1-27(2)19-9-7-16(8-10-19)23-25-20-11-6-15(12-21(20)26-23)13-22(28)17-4-3-5-18(24)14-17;1-30-18-9-7-16(8-10-18)22-25-19-11-2-14(12-20(19)26-22)13-21(28)15-3-5-17(6-4-15)23(29)27-24;1-27-18-8-6-15(7-9-18)22-24-19-10-5-14(11-20(19)25-22)12-21(26)16-3-2-4-17(23)13-16;1-26-18-10-8-16(9-11-18)21(25)14-15-7-12-19-20(13-15)24-22(23-19)17-5-3-2-4-6-17;24-19(15-8-10-21-11-9-15)13-14-6-7-17-18(12-14)23-20(22-17)16-4-2-1-3-5-16/h3-17,19H,18,20H2,1-2H3,(H,31,32);2*4-14,16H,15H2,1-3H3,(H,27,28);2-16H,17H2,1H3,(H,27,28);3,5-14,16H,4,15H2,1-2H3,(H,27,28);3-13,15,26H,14H2,1-2H3,(H,27,28);5-14,16H,15H2,1-4H3,(H,26,27);3-12,14H,13H2,1-2H3,(H,25,26);2-12H,13,24H2,1H3,(H,25,26)(H,27,29);2-11,13H,12H2,1H3,(H,24,25);2-13H,14H2,1H3,(H,23,24);1-12H,13H2,(H,22,23)
InChIKeyGLIPQXXINABUHQ-UHFFFAOYSA-N
XLogP60.15
TPSA710.43 Ų
H-Bond Donors15
H-Bond Acceptors42
Rotatable Bonds64
Heavy Atoms352
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004679.45
LogP ≤ 560.15
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1042

Analyze 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone?
The IUPAC name of 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone (CID 158290943) is 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone.
What is the SMILES notation for 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone?
The canonical SMILES for 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone is CN(C)c1ccc(-c2nc3ccc(CC(=O)c4ccc5[nH]ccc5c4)cc3[nH]2)cc1.CN(C)c1ccc(-c2nc3ccc(CC(=O)c4cccc(Cl)c4)cc3[nH]2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc(Cc5ccccc5)cc4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5c(c4)C=CC5)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5c(ccn5C)c4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4ccc5ccn(C)c5c4)[nH]c3c2)cc1.CN(C)c1ccc(C(=O)Cc2ccc3nc(-c4cccc(N(C)C)c4)[nH]c3c2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4ccc(-n5cccc5)cc4)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4ccc(C(=O)NN)cc4)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(CC(=O)c4cccc(Cl)c4)cc3[nH]2)cc1.COc1ccc(C(=O)Cc2ccc3nc(-c4ccccc4)[nH]c3c2)cc1.O=C(Cc1ccc2nc(-c3ccccc3)[nH]c2c1)c1ccncc1.
What is the InChIKey of 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone?
The InChIKey is GLIPQXXINABUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27N3O.2C26H24N4O.C26H21N3O2.C26H23N3O.C25H22N4O.C25H26N4O.C23H20ClN3O.C23H20N4O3.C22H17ClN2O2.C22H18N2O2.C20H15N3O/c1-33(2)26-15-13-24(14-16-26)29(34)20-23-10-17-27-28(19-23)32-30(31-27)25-11-8-22(9-12-25)18-21-6-4-3-5-7-21;1-29(2)21-8-5-18(6-9-21)25(31)15-17-4-10-22-23(14-17)28-26(27-22)20-7-11-24-19(16-20)12-13-30(24)3;1-29(2)21-9-7-19(8-10-21)25(31)15-17-4-11-22-23(14-17)28-26(27-22)20-6-5-18-12-13-30(3)24(18)16-20;1-31-22-11-7-20(8-12-22)26-27-23-13-4-18(16-24(23)28-26)17-25(30)19-5-9-21(10-6-19)29-14-2-3-15-29;1-29(2)22-11-9-19(10-12-22)25(30)15-17-6-13-23-24(14-17)28-26(27-23)21-8-7-18-4-3-5-20(18)16-21;1-29(2)20-7-4-17(5-8-20)25-27-22-9-3-16(13-23(22)28-25)14-24(30)19-6-10-21-18(15-19)11-12-26-21;1-28(2)20-11-9-18(10-12-20)24(30)15-17-8-13-22-23(14-17)27-25(26-22)19-6-5-7-21(16-19)29(3)4;1-27(2)19-9-7-16(8-10-19)23-25-20-11-6-15(12-21(20)26-23)13-22(28)17-4-3-5-18(24)14-17;1-30-18-9-7-16(8-10-18)22-25-19-11-2-14(12-20(19)26-22)13-21(28)15-3-5-17(6-4-15)23(29)27-24;1-27-18-8-6-15(7-9-18)22-24-19-10-5-14(11-20(19)25-22)12-21(26)16-3-2-4-17(23)13-16;1-26-18-10-8-16(9-11-18)21(25)14-15-7-12-19-20(13-15)24-22(23-19)17-5-3-2-4-6-17;24-19(15-8-10-21-11-9-15)13-14-6-7-17-18(12-14)23-20(22-17)16-4-2-1-3-5-16/h3-17,19H,18,20H2,1-2H3,(H,31,32);2*4-14,16H,15H2,1-3H3,(H,27,28);2-16H,17H2,1H3,(H,27,28);3,5-14,16H,4,15H2,1-2H3,(H,27,28);3-13,15,26H,14H2,1-2H3,(H,27,28);5-14,16H,15H2,1-4H3,(H,26,27);3-12,14H,13H2,1-2H3,(H,25,26);2-12H,13,24H2,1H3,(H,25,26)(H,27,29);2-11,13H,12H2,1H3,(H,24,25);2-13H,14H2,1H3,(H,23,24);1-12H,13H2,(H,22,23).
What are the key properties of 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone?
2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone has a molecular weight of 4679.45 g/mol, XLogP of 60.15, 64 rotatable bonds, 15 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-1-[4-(dimethylamino)phenyl]ethanone;1-(3-chlorophenyl)-2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-(3-chlorophenyl)-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]ethanone;2-[2-[4-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]-1-(1H-indol-5-yl)ethanone;1-[4-(dimethylamino)phenyl]-2-[2-[3-(dimethylamino)phenyl]-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1H-inden-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-5-yl)-3H-benzimidazol-5-yl]ethanone;1-[4-(dimethylamino)phenyl]-2-[2-(1-methylindol-6-yl)-3H-benzimidazol-5-yl]ethanone;4-[2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]acetyl]benzohydrazide;2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-1-(4-pyrrol-1-ylphenyl)ethanone;1-(4-methoxyphenyl)-2-(2-phenyl-3H-benzimidazol-5-yl)ethanone;2-(2-phenyl-3H-benzimidazol-5-yl)-1-pyridin-4-ylethanone is sourced from PubChem (CID 158290943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).