2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane

C67H57BrN8 — CID 158746989

IUPAC2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane
SMILESBrc1ccc(-c2nc3cnccc3n2-c2ccccc2)cc1.C.CC1(C)c2ccccc2N(c2ccc(-c3nc4cnccc4n3-c3ccccc3)cc2)c2ccccc21.CC1(C)c2ccccc2Nc2ccccc21
InChIInChI=1S/C33H26N4.C18H12BrN3.C15H15N.CH4/c1-33(2)26-12-6-8-14-29(26)36(30-15-9-7-13-27(30)33)25-18-16-23(17-19-25)32-35-28-22-34-21-20-31(28)37(32)24-10-4-3-5-11-24;19-14-8-6-13(7-9-14)18-21-16-12-20-11-10-17(16)22(18)15-4-2-1-3-5-15;1-15(2)11-7-3-5-9-13(11)16-14-10-6-4-8-12(14)15;/h3-22H,1-2H3;1-12H;3-10,16H,1-2H3;1H4
InChIKeyIMZVFWGDVQOGNP-UHFFFAOYSA-N
MW1054.15 g/mol
LogP17.75
Rot. Bonds5

About 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane

2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane (PubChem CID 158746989) has the molecular formula C67H57BrN8 and a molecular weight of 1054.15 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane.

Molecular Properties

Compound Name2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane
PubChem CID158746989
Molecular FormulaC67H57BrN8
Molecular Weight1054.15 g/mol
Exact Mass1052.39
IUPAC Name2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane
SMILESBrc1ccc(-c2nc3cnccc3n2-c2ccccc2)cc1.C.CC1(C)c2ccccc2N(c2ccc(-c3nc4cnccc4n3-c3ccccc3)cc2)c2ccccc21.CC1(C)c2ccccc2Nc2ccccc21
InChIInChI=1S/C33H26N4.C18H12BrN3.C15H15N.CH4/c1-33(2)26-12-6-8-14-29(26)36(30-15-9-7-13-27(30)33)25-18-16-23(17-19-25)32-35-28-22-34-21-20-31(28)37(32)24-10-4-3-5-11-24;19-14-8-6-13(7-9-14)18-21-16-12-20-11-10-17(16)22(18)15-4-2-1-3-5-15;1-15(2)11-7-3-5-9-13(11)16-14-10-6-4-8-12(14)15;/h3-22H,1-2H3;1-12H;3-10,16H,1-2H3;1H4
InChIKeyIMZVFWGDVQOGNP-UHFFFAOYSA-N
XLogP17.75
TPSA76.69 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001054.15
LogP ≤ 517.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane with MolForge

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Related Compounds

2-(4-Bromophenyl)-3-[[4-[[2-(4-bromophenyl)imidazo[1,2-a]pyrimidin-3-yl]methyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
CID 122183061
8-(4,4-dimethylcyclohexyl)-N-[5-(4-pyrrolidin-1-ylpiperidin-1-yl)-2-pyridinyl]-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 58299684
N-[6-[4-(dimethylamino)piperidin-1-yl]-3-pyridinyl]-8-(4,4-dimethylcyclohexyl)-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 58299832
3-[6-Bromo-3-(4-tert-butylphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 58345162
10-(4-Bromophenyl)-9-(4-methylphenyl)-7,8-dihydroimidazo[1,2-a][1,10]phenanthrolin-12-ium;bromide
CID 2319091
6-{1-[6-(4-Bromo-3-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]cyclopropyl}quinoline
CID 67225168
N-[4-[4-amino-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]-5-fluoro-4-methylquinazolin-2-amine
CID 69787523
N-[4-[4-amino-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]-6-fluoro-4-methylquinazolin-2-amine
CID 69788215
2-[[4-[[3-[1-[4-[(5-Amino-7-fluoroimidazo[1,2-c]quinazolin-2-yl)methyl]piperazin-1-yl]ethyl]phenyl]methyl]piperazin-1-yl]methyl]-7-fluoroimidazo[1,2-c]quinazolin-5-amine
CID 138721026
2-[4-[3-(6,8-Difluoro-2-methylquinolin-4-yl)imidazo[1,2-a]pyridin-7-yl]phenyl]-2,8-diazaspiro[4.5]decane
CID 139495330
8-[4-[3-(6,8-Difluoro-2-methylquinolin-4-yl)imidazo[1,2-a]pyridin-7-yl]phenyl]-2,8-diazaspiro[4.5]decane
CID 139495337
2-[4-[3-(6,8-Difluoro-2-methylquinolin-4-yl)imidazo[1,2-a]pyridin-7-yl]phenyl]-2,9-diazaspiro[4.5]decane
CID 139495339

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane?
The IUPAC name of 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane (CID 158746989) is 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane.
What is the SMILES notation for 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane?
The canonical SMILES for 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane is Brc1ccc(-c2nc3cnccc3n2-c2ccccc2)cc1.C.CC1(C)c2ccccc2N(c2ccc(-c3nc4cnccc4n3-c3ccccc3)cc2)c2ccccc21.CC1(C)c2ccccc2Nc2ccccc21.
What is the InChIKey of 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane?
The InChIKey is IMZVFWGDVQOGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26N4.C18H12BrN3.C15H15N.CH4/c1-33(2)26-12-6-8-14-29(26)36(30-15-9-7-13-27(30)33)25-18-16-23(17-19-25)32-35-28-22-34-21-20-31(28)37(32)24-10-4-3-5-11-24;19-14-8-6-13(7-9-14)18-21-16-12-20-11-10-17(16)22(18)15-4-2-1-3-5-15;1-15(2)11-7-3-5-9-13(11)16-14-10-6-4-8-12(14)15;/h3-22H,1-2H3;1-12H;3-10,16H,1-2H3;1H4.
What are the key properties of 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane?
2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane has a molecular weight of 1054.15 g/mol, XLogP of 17.75, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1-phenylimidazo[4,5-c]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(1-phenylimidazo[4,5-c]pyridin-2-yl)phenyl]acridine;methane is sourced from PubChem (CID 158746989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).