N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide

C82H61Br2Cl3N14O4 — CID 157279252

IUPACN-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide
SMILESO=C(Cn1c(-c2ccccc2)nc2ccccc21)Nc1ccc(Br)cc1.O=C(Cn1c(-c2ccccc2Cl)nc2ccccc21)Nc1ccc(Cl)cc1.O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(Br)cc1.O=C(Cn1c(-c2cccnc2)nc2ccccc21)Nc1ccc(Cl)cc1
InChIInChI=1S/C21H16BrN3O.C21H15Cl2N3O.C20H15BrN4O.C20H15ClN4O/c22-16-10-12-17(13-11-16)23-20(26)14-25-19-9-5-4-8-18(19)24-21(25)15-6-2-1-3-7-15;22-14-9-11-15(12-10-14)24-20(27)13-26-19-8-4-3-7-18(19)25-21(26)16-5-1-2-6-17(16)23;21-14-8-10-15(11-9-14)23-19(26)13-25-18-7-2-1-5-16(18)24-20(25)17-6-3-4-12-22-17;21-15-7-9-16(10-8-15)23-19(26)13-25-18-6-2-1-5-17(18)24-20(25)14-4-3-11-22-12-14/h1-13H,14H2,(H,23,26);1-12H,13H2,(H,24,27);2*1-12H,13H2,(H,23,26)
InChIKeyAZLUQKSGEGDDGE-UHFFFAOYSA-N
MW1572.65 g/mol
LogP19.64
Rot. Bonds16

About N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide

N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide (PubChem CID 157279252) has the molecular formula C82H61Br2Cl3N14O4 and a molecular weight of 1572.65 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide
PubChem CID157279252
Molecular FormulaC82H61Br2Cl3N14O4
Molecular Weight1572.65 g/mol
Exact Mass1568.24
IUPAC NameN-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide
SMILESO=C(Cn1c(-c2ccccc2)nc2ccccc21)Nc1ccc(Br)cc1.O=C(Cn1c(-c2ccccc2Cl)nc2ccccc21)Nc1ccc(Cl)cc1.O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(Br)cc1.O=C(Cn1c(-c2cccnc2)nc2ccccc21)Nc1ccc(Cl)cc1
InChIInChI=1S/C21H16BrN3O.C21H15Cl2N3O.C20H15BrN4O.C20H15ClN4O/c22-16-10-12-17(13-11-16)23-20(26)14-25-19-9-5-4-8-18(19)24-21(25)15-6-2-1-3-7-15;22-14-9-11-15(12-10-14)24-20(27)13-26-19-8-4-3-7-18(19)25-21(26)16-5-1-2-6-17(16)23;21-14-8-10-15(11-9-14)23-19(26)13-25-18-7-2-1-5-16(18)24-20(25)17-6-3-4-12-22-17;21-15-7-9-16(10-8-15)23-19(26)13-25-18-6-2-1-5-17(18)24-20(25)14-4-3-11-22-12-14/h1-13H,14H2,(H,23,26);1-12H,13H2,(H,24,27);2*1-12H,13H2,(H,23,26)
InChIKeyAZLUQKSGEGDDGE-UHFFFAOYSA-N
XLogP19.64
TPSA213.46 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds16
Heavy Atoms105
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001572.65
LogP ≤ 519.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

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Related Compounds

3-(4-Bromo-2-chlorophenyl)-1-(pyridin-4-yl)benzo[4,5]imidazo[1,2-d][1,2,4]triazin-4(3H)-one
CID 168326456
N-(4-chloro-3-cyanophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chloro-3-cyanophenyl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-naphthalen-2-yl-2-(2-phenylbenzimidazol-1-yl)acetamide;N-naphthalen-2-yl-2-(2-pyridin-2-ylbenzimidazol-1-yl)propanamide
CID 157478356
N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-[(4-chlorophenyl)methylideneamino]-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide
CID 157757045
N-(3-chloro-4-isocyanophenyl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-(6-chloro-3-pyridinyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(6-chloro-3-pyridinyl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-(4-isocyanophenyl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide
CID 158728443
2-(benzimidazol-1-yl)-N-(4-bromophenyl)acetamide;2-(benzimidazol-1-yl)-N-[4-(2-chlorophenyl)phenyl]acetamide
CID 159521762
bis(N-(4-chlorophenyl)-2-[2-(4-methylphenyl)benzimidazol-1-yl]acetamide);N-(4-chlorophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-isocyanophenyl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide
CID 159638432
1-benzyl-6-bromo-2-chloroimidazo[4,5-b]pyridine;1-benzyl-6-bromo-N,N-dimethylimidazo[4,5-b]pyridin-2-amine;N-[1-benzyl-2-(dimethylamino)imidazo[4,5-b]pyridin-6-yl]-N-methylprop-2-enamide;1-benzyl-6-ethyl-N,N-dimethylimidazo[4,5-b]pyridin-2-amine;methanamine;N-methylmethanamine;prop-2-enoyl chloride;hydrochloride
CID 159759219
N-[(4-chlorophenyl)methyl]-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-pyrrol-1-ylacetamide
CID 160226404
1-benzyl-6-bromo-2-chloroimidazo[4,5-b]pyridine;1-benzyl-6-bromo-2-(2,5-dihydropyrrol-1-yl)imidazo[4,5-b]pyridine;1-benzyl-2-(2,5-dihydropyrrol-1-yl)-6-ethylimidazo[4,5-b]pyridine;N-[1-benzyl-2-(2,5-dihydropyrrol-1-yl)imidazo[4,5-b]pyridin-6-yl]-N-methylprop-2-enamide;2,5-dihydro-1H-pyrrole;methanamine;methane;prop-2-enoyl chloride
CID 160522210
2-(benzotriazol-1-yl)-N-(4-methylphenyl)acetamide;1-[[1-(4-chlorophenyl)triazol-4-yl]methyl]-2-(3H-pyrrol-5-yl)benzimidazole;methane;bis(1-[[1-(4-methylphenyl)triazol-4-yl]methyl]-2-phenylbenzimidazole);1-[[1-(4-methylphenyl)triazol-4-yl]methyl]-2-pyridin-2-ylbenzimidazole
CID 160565979
N-(3-chloro-4-isocyanophenyl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-(6-chloro-3-pyridinyl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-(5-chloropyrimidin-2-yl)-2-[2-(3H-pyrrol-5-yl)benzimidazol-1-yl]acetamide;N-(4-methylphenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide
CID 160630521
2-(benzotriazol-1-yl)-N-(4-methylphenyl)acetamide;1-[[1-(4-chlorophenyl)triazol-4-yl]methyl]-2-(3H-pyrrol-5-yl)benzimidazole;methane;bis(1-[[1-(4-methylphenyl)triazol-4-yl]methyl]-2-phenylbenzimidazole);bis(1-[[1-(4-methylphenyl)triazol-4-yl]methyl]-2-pyridin-2-ylbenzimidazole)
CID 160797843

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide (CID 157279252) is N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide is O=C(Cn1c(-c2ccccc2)nc2ccccc21)Nc1ccc(Br)cc1.O=C(Cn1c(-c2ccccc2Cl)nc2ccccc21)Nc1ccc(Cl)cc1.O=C(Cn1c(-c2ccccn2)nc2ccccc21)Nc1ccc(Br)cc1.O=C(Cn1c(-c2cccnc2)nc2ccccc21)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide?
The InChIKey is AZLUQKSGEGDDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16BrN3O.C21H15Cl2N3O.C20H15BrN4O.C20H15ClN4O/c22-16-10-12-17(13-11-16)23-20(26)14-25-19-9-5-4-8-18(19)24-21(25)15-6-2-1-3-7-15;22-14-9-11-15(12-10-14)24-20(27)13-26-19-8-4-3-7-18(19)25-21(26)16-5-1-2-6-17(16)23;21-14-8-10-15(11-9-14)23-19(26)13-25-18-7-2-1-5-16(18)24-20(25)17-6-3-4-12-22-17;21-15-7-9-16(10-8-15)23-19(26)13-25-18-6-2-1-5-17(18)24-20(25)14-4-3-11-22-12-14/h1-13H,14H2,(H,23,26);1-12H,13H2,(H,24,27);2*1-12H,13H2,(H,23,26).
What are the key properties of N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide?
N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide has a molecular weight of 1572.65 g/mol, XLogP of 19.64, 16 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide;N-(4-bromophenyl)-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide;N-(4-chlorophenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide;N-(4-chlorophenyl)-2-(2-pyridin-3-ylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 157279252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).