3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole

C151H112Br5N15O — CID 157497548

IUPAC3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole
SMILESCc1[nH]c2ccc(Br)cc2c1-c1nc(-c2ccc(-c3ccccc3)cc2)c(-c2ccc(-c3ccccc3)cc2)[nH]1.Cc1[nH]c2ccc(Br)cc2c1-c1nc(-c2ccccc2)c(-c2ccc(Br)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2ccc(-c3ccccc3)cc2)c(-c2ccc(-c3ccccc3)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2ccccc2)c(-c2ccc(Br)cc2)[nH]1.Cc1ccc(-c2[nH]c(-c3c(C)[nH]c4ccc(Br)cc34)nc2-c2ccc(Oc3ccccc3)cc2)cc1
InChIInChI=1S/C36H26BrN3.C36H27N3.C31H24BrN3O.C24H17Br2N3.C24H18BrN3/c1-23-33(31-22-30(37)20-21-32(31)38-23)36-39-34(28-16-12-26(13-17-28)24-8-4-2-5-9-24)35(40-36)29-18-14-27(15-19-29)25-10-6-3-7-11-25;1-24-33(31-14-8-9-15-32(31)37-24)36-38-34(29-20-16-27(17-21-29)25-10-4-2-5-11-25)35(39-36)30-22-18-28(19-23-30)26-12-6-3-7-13-26;1-19-8-10-21(11-9-19)29-30(22-12-15-25(16-13-22)36-24-6-4-3-5-7-24)35-31(34-29)28-20(2)33-27-17-14-23(32)18-26(27)28;1-14-21(19-13-18(26)11-12-20(19)27-14)24-28-22(15-5-3-2-4-6-15)23(29-24)16-7-9-17(25)10-8-16;1-15-21(19-9-5-6-10-20(19)26-15)24-27-22(16-7-3-2-4-8-16)23(28-24)17-11-13-18(25)14-12-17/h2-22,38H,1H3,(H,39,40);2-23,37H,1H3,(H,38,39);3-18,33H,1-2H3,(H,34,35);2-13,27H,1H3,(H,28,29);2-14,26H,1H3,(H,27,28)
InChIKeyBXZYUPZAGVRYJK-UHFFFAOYSA-N
MW2552.18 g/mol
LogP43.58
Rot. Bonds21

About 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole

3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole (PubChem CID 157497548) has the molecular formula C151H112Br5N15O and a molecular weight of 2552.18 g/mol. Its IUPAC name is 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole.

Molecular Properties

Compound Name3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole
PubChem CID157497548
Molecular FormulaC151H112Br5N15O
Molecular Weight2552.18 g/mol
Exact Mass2545.51
IUPAC Name3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole
SMILESCc1[nH]c2ccc(Br)cc2c1-c1nc(-c2ccc(-c3ccccc3)cc2)c(-c2ccc(-c3ccccc3)cc2)[nH]1.Cc1[nH]c2ccc(Br)cc2c1-c1nc(-c2ccccc2)c(-c2ccc(Br)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2ccc(-c3ccccc3)cc2)c(-c2ccc(-c3ccccc3)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2ccccc2)c(-c2ccc(Br)cc2)[nH]1.Cc1ccc(-c2[nH]c(-c3c(C)[nH]c4ccc(Br)cc34)nc2-c2ccc(Oc3ccccc3)cc2)cc1
InChIInChI=1S/C36H26BrN3.C36H27N3.C31H24BrN3O.C24H17Br2N3.C24H18BrN3/c1-23-33(31-22-30(37)20-21-32(31)38-23)36-39-34(28-16-12-26(13-17-28)24-8-4-2-5-9-24)35(40-36)29-18-14-27(15-19-29)25-10-6-3-7-11-25;1-24-33(31-14-8-9-15-32(31)37-24)36-38-34(29-20-16-27(17-21-29)25-10-4-2-5-11-25)35(39-36)30-22-18-28(19-23-30)26-12-6-3-7-13-26;1-19-8-10-21(11-9-19)29-30(22-12-15-25(16-13-22)36-24-6-4-3-5-7-24)35-31(34-29)28-20(2)33-27-17-14-23(32)18-26(27)28;1-14-21(19-13-18(26)11-12-20(19)27-14)24-28-22(15-5-3-2-4-6-15)23(29-24)16-7-9-17(25)10-8-16;1-15-21(19-9-5-6-10-20(19)26-15)24-27-22(16-7-3-2-4-8-16)23(28-24)17-11-13-18(25)14-12-17/h2-22,38H,1H3,(H,39,40);2-23,37H,1H3,(H,38,39);3-18,33H,1-2H3,(H,34,35);2-13,27H,1H3,(H,28,29);2-14,26H,1H3,(H,27,28)
InChIKeyBXZYUPZAGVRYJK-UHFFFAOYSA-N
XLogP43.58
TPSA231.58 Ų
H-Bond Donors10
H-Bond Acceptors6
Rotatable Bonds21
Heavy Atoms172
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002552.18
LogP ≤ 543.58
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imidazole_A(19)', 'substructure': 'N/A'}

Analyze 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole?
The IUPAC name of 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole (CID 157497548) is 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole.
What is the SMILES notation for 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole?
The canonical SMILES for 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole is Cc1[nH]c2ccc(Br)cc2c1-c1nc(-c2ccc(-c3ccccc3)cc2)c(-c2ccc(-c3ccccc3)cc2)[nH]1.Cc1[nH]c2ccc(Br)cc2c1-c1nc(-c2ccccc2)c(-c2ccc(Br)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2ccc(-c3ccccc3)cc2)c(-c2ccc(-c3ccccc3)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2ccccc2)c(-c2ccc(Br)cc2)[nH]1.Cc1ccc(-c2[nH]c(-c3c(C)[nH]c4ccc(Br)cc34)nc2-c2ccc(Oc3ccccc3)cc2)cc1.
What is the InChIKey of 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole?
The InChIKey is BXZYUPZAGVRYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26BrN3.C36H27N3.C31H24BrN3O.C24H17Br2N3.C24H18BrN3/c1-23-33(31-22-30(37)20-21-32(31)38-23)36-39-34(28-16-12-26(13-17-28)24-8-4-2-5-9-24)35(40-36)29-18-14-27(15-19-29)25-10-6-3-7-11-25;1-24-33(31-14-8-9-15-32(31)37-24)36-38-34(29-20-16-27(17-21-29)25-10-4-2-5-11-25)35(39-36)30-22-18-28(19-23-30)26-12-6-3-7-13-26;1-19-8-10-21(11-9-19)29-30(22-12-15-25(16-13-22)36-24-6-4-3-5-7-24)35-31(34-29)28-20(2)33-27-17-14-23(32)18-26(27)28;1-14-21(19-13-18(26)11-12-20(19)27-14)24-28-22(15-5-3-2-4-6-15)23(29-24)16-7-9-17(25)10-8-16;1-15-21(19-9-5-6-10-20(19)26-15)24-27-22(16-7-3-2-4-8-16)23(28-24)17-11-13-18(25)14-12-17/h2-22,38H,1H3,(H,39,40);2-23,37H,1H3,(H,38,39);3-18,33H,1-2H3,(H,34,35);2-13,27H,1H3,(H,28,29);2-14,26H,1H3,(H,27,28).
What are the key properties of 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole?
3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole has a molecular weight of 2552.18 g/mol, XLogP of 43.58, 21 rotatable bonds, 10 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-2-methyl-1H-indole;3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-2-methyl-3-[5-(4-methylphenyl)-4-(4-phenoxyphenyl)-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole is sourced from PubChem (CID 157497548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).