2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole

C138H125Br4Cl6FN12O4 — CID 158551300

IUPAC2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
SMILESCOc1ccc(-c2ccc(Br)cc2CCc2c(Cl)cccc2C2=NCCN2)cc1.COc1ccc2cc(Br)ccc2c1CCc1c(Cl)cccc1C1=NCCN1.COc1cccc(-c2ccc(Br)cc2CCc2c(Cl)cccc2C2=NCCN2)c1.COc1ccccc1-c1ccc(Br)cc1CCc1c(Cl)cccc1C1=NCCN1.Clc1cccc(C2=NCCN2)c1CCc1ccccc1-c1ccccc1.Fc1ccc(CCc2c(Cl)cccc2C2=NCCN2)c2ccccc12
InChIInChI=1S/3C24H22BrClN2O.C23H21ClN2.C22H20BrClN2O.C21H18ClFN2/c1-29-19-5-2-4-16(15-19)20-11-9-18(25)14-17(20)8-10-21-22(6-3-7-23(21)26)24-27-12-13-28-24;1-29-23-8-3-2-5-20(23)18-12-10-17(25)15-16(18)9-11-19-21(6-4-7-22(19)26)24-27-13-14-28-24;1-29-19-9-5-16(6-10-19)20-12-8-18(25)15-17(20)7-11-21-22(3-2-4-23(21)26)24-27-13-14-28-24;24-22-12-6-11-21(23-25-15-16-26-23)20(22)14-13-18-9-4-5-10-19(18)17-7-2-1-3-8-17;1-27-21-10-5-14-13-15(23)6-7-16(14)18(21)9-8-17-19(3-2-4-20(17)24)22-25-11-12-26-22;22-19-7-3-6-18(21-24-12-13-25-21)16(19)10-8-14-9-11-20(23)17-5-2-1-4-15(14)17/h2-7,9,11,14-15H,8,10,12-13H2,1H3,(H,27,28);2-8,10,12,15H,9,11,13-14H2,1H3,(H,27,28);2-6,8-10,12,15H,7,11,13-14H2,1H3,(H,27,28);1-12H,13-16H2,(H,25,26);2-7,10,13H,8-9,11-12H2,1H3,(H,25,26);1-7,9,11H,8,10,12-13H2,(H,24,25)
InChIKeyHPTIUTHONFPKBT-UHFFFAOYSA-N
MW2566.93 g/mol
LogP33.05
Rot. Bonds32

About 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole

2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 158551300) has the molecular formula C138H125Br4Cl6FN12O4 and a molecular weight of 2566.93 g/mol. Its IUPAC name is 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
PubChem CID158551300
Molecular FormulaC138H125Br4Cl6FN12O4
Molecular Weight2566.93 g/mol
Exact Mass2558.48
IUPAC Name2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
SMILESCOc1ccc(-c2ccc(Br)cc2CCc2c(Cl)cccc2C2=NCCN2)cc1.COc1ccc2cc(Br)ccc2c1CCc1c(Cl)cccc1C1=NCCN1.COc1cccc(-c2ccc(Br)cc2CCc2c(Cl)cccc2C2=NCCN2)c1.COc1ccccc1-c1ccc(Br)cc1CCc1c(Cl)cccc1C1=NCCN1.Clc1cccc(C2=NCCN2)c1CCc1ccccc1-c1ccccc1.Fc1ccc(CCc2c(Cl)cccc2C2=NCCN2)c2ccccc12
InChIInChI=1S/3C24H22BrClN2O.C23H21ClN2.C22H20BrClN2O.C21H18ClFN2/c1-29-19-5-2-4-16(15-19)20-11-9-18(25)14-17(20)8-10-21-22(6-3-7-23(21)26)24-27-12-13-28-24;1-29-23-8-3-2-5-20(23)18-12-10-17(25)15-16(18)9-11-19-21(6-4-7-22(19)26)24-27-13-14-28-24;1-29-19-9-5-16(6-10-19)20-12-8-18(25)15-17(20)7-11-21-22(3-2-4-23(21)26)24-27-13-14-28-24;24-22-12-6-11-21(23-25-15-16-26-23)20(22)14-13-18-9-4-5-10-19(18)17-7-2-1-3-8-17;1-27-21-10-5-14-13-15(23)6-7-16(14)18(21)9-8-17-19(3-2-4-20(17)24)22-25-11-12-26-22;22-19-7-3-6-18(21-24-12-13-25-21)16(19)10-8-14-9-11-20(23)17-5-2-1-4-15(14)17/h2-7,9,11,14-15H,8,10,12-13H2,1H3,(H,27,28);2-8,10,12,15H,9,11,13-14H2,1H3,(H,27,28);2-6,8-10,12,15H,7,11,13-14H2,1H3,(H,27,28);1-12H,13-16H2,(H,25,26);2-7,10,13H,8-9,11-12H2,1H3,(H,25,26);1-7,9,11H,8,10,12-13H2,(H,24,25)
InChIKeyHPTIUTHONFPKBT-UHFFFAOYSA-N
XLogP33.05
TPSA183.26 Ų
H-Bond Donors6
H-Bond Acceptors16
Rotatable Bonds32
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002566.93
LogP ≤ 533.05
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1016

Analyze 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole (CID 158551300) is 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole is COc1ccc(-c2ccc(Br)cc2CCc2c(Cl)cccc2C2=NCCN2)cc1.COc1ccc2cc(Br)ccc2c1CCc1c(Cl)cccc1C1=NCCN1.COc1cccc(-c2ccc(Br)cc2CCc2c(Cl)cccc2C2=NCCN2)c1.COc1ccccc1-c1ccc(Br)cc1CCc1c(Cl)cccc1C1=NCCN1.Clc1cccc(C2=NCCN2)c1CCc1ccccc1-c1ccccc1.Fc1ccc(CCc2c(Cl)cccc2C2=NCCN2)c2ccccc12.
What is the InChIKey of 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is HPTIUTHONFPKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/3C24H22BrClN2O.C23H21ClN2.C22H20BrClN2O.C21H18ClFN2/c1-29-19-5-2-4-16(15-19)20-11-9-18(25)14-17(20)8-10-21-22(6-3-7-23(21)26)24-27-12-13-28-24;1-29-23-8-3-2-5-20(23)18-12-10-17(25)15-16(18)9-11-19-21(6-4-7-22(19)26)24-27-13-14-28-24;1-29-19-9-5-16(6-10-19)20-12-8-18(25)15-17(20)7-11-21-22(3-2-4-23(21)26)24-27-13-14-28-24;24-22-12-6-11-21(23-25-15-16-26-23)20(22)14-13-18-9-4-5-10-19(18)17-7-2-1-3-8-17;1-27-21-10-5-14-13-15(23)6-7-16(14)18(21)9-8-17-19(3-2-4-20(17)24)22-25-11-12-26-22;22-19-7-3-6-18(21-24-12-13-25-21)16(19)10-8-14-9-11-20(23)17-5-2-1-4-15(14)17/h2-7,9,11,14-15H,8,10,12-13H2,1H3,(H,27,28);2-8,10,12,15H,9,11,13-14H2,1H3,(H,27,28);2-6,8-10,12,15H,7,11,13-14H2,1H3,(H,27,28);1-12H,13-16H2,(H,25,26);2-7,10,13H,8-9,11-12H2,1H3,(H,25,26);1-7,9,11H,8,10,12-13H2,(H,24,25).
What are the key properties of 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole?
2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 2566.93 g/mol, XLogP of 33.05, 32 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(6-bromo-2-methoxynaphthalen-1-yl)ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(2-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(3-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[2-[2-[5-bromo-2-(4-methoxyphenyl)phenyl]ethyl]-3-chlorophenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(4-fluoronaphthalen-1-yl)ethyl]phenyl]-4,5-dihydro-1H-imidazole;2-[3-chloro-2-[2-(2-phenylphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 158551300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).