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

C120H85Br2Cl8N15 — CID 161011003

IUPAC3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole
SMILESCc1[nH]c2ccccc2c1-c1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2cccc(Cl)c2)c(-c2cccc(Cl)c2)[nH]1.Cc1ccc(-c2nc(-c3c(C)[nH]c4ccccc34)[nH]c2-c2ccc(C)cc2)cc1.Clc1ccc(-c2nc(-c3c[nH]c4ccc(Br)cc34)[nH]c2-c2ccc(Cl)cc2)cc1.Clc1cccc(-c2nc(-c3c[nH]c4ccc(Br)cc34)[nH]c2-c2cccc(Cl)c2)c1
InChIInChI=1S/C26H23N3.2C24H17Cl2N3.2C23H14BrCl2N3/c1-16-8-12-19(13-9-16)24-25(20-14-10-17(2)11-15-20)29-26(28-24)23-18(3)27-22-7-5-4-6-21(22)23;1-14-21(19-10-2-3-11-20(19)27-14)24-28-22(15-6-4-8-17(25)12-15)23(29-24)16-7-5-9-18(26)13-16;1-14-21(19-4-2-3-5-20(19)27-14)24-28-22(15-6-10-17(25)11-7-15)23(29-24)16-8-12-18(26)13-9-16;24-15-5-10-20-18(11-15)19(12-27-20)23-28-21(13-1-6-16(25)7-2-13)22(29-23)14-3-8-17(26)9-4-14;24-15-7-8-20-18(11-15)19(12-27-20)23-28-21(13-3-1-5-16(25)9-13)22(29-23)14-4-2-6-17(26)10-14/h4-15,27H,1-3H3,(H,28,29);2*2-13,27H,1H3,(H,28,29);2*1-12,27H,(H,28,29)
InChIKeyTXCPELNEDXHRPW-UHFFFAOYSA-N
MW2180.54 g/mol
LogP37.75
Rot. Bonds15

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

3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole (PubChem CID 161011003) has the molecular formula C120H85Br2Cl8N15 and a molecular weight of 2180.54 g/mol. Its IUPAC name is 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole.

Molecular Properties

Compound Name3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole
PubChem CID161011003
Molecular FormulaC120H85Br2Cl8N15
Molecular Weight2180.54 g/mol
Exact Mass2173.30
IUPAC Name3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole
SMILESCc1[nH]c2ccccc2c1-c1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2cccc(Cl)c2)c(-c2cccc(Cl)c2)[nH]1.Cc1ccc(-c2nc(-c3c(C)[nH]c4ccccc34)[nH]c2-c2ccc(C)cc2)cc1.Clc1ccc(-c2nc(-c3c[nH]c4ccc(Br)cc34)[nH]c2-c2ccc(Cl)cc2)cc1.Clc1cccc(-c2nc(-c3c[nH]c4ccc(Br)cc34)[nH]c2-c2cccc(Cl)c2)c1
InChIInChI=1S/C26H23N3.2C24H17Cl2N3.2C23H14BrCl2N3/c1-16-8-12-19(13-9-16)24-25(20-14-10-17(2)11-15-20)29-26(28-24)23-18(3)27-22-7-5-4-6-21(22)23;1-14-21(19-10-2-3-11-20(19)27-14)24-28-22(15-6-4-8-17(25)12-15)23(29-24)16-7-5-9-18(26)13-16;1-14-21(19-4-2-3-5-20(19)27-14)24-28-22(15-6-10-17(25)11-7-15)23(29-24)16-8-12-18(26)13-9-16;24-15-5-10-20-18(11-15)19(12-27-20)23-28-21(13-1-6-16(25)7-2-13)22(29-23)14-3-8-17(26)9-4-14;24-15-7-8-20-18(11-15)19(12-27-20)23-28-21(13-3-1-5-16(25)9-13)22(29-23)14-4-2-6-17(26)10-14/h4-15,27H,1-3H3,(H,28,29);2*2-13,27H,1H3,(H,28,29);2*1-12,27H,(H,28,29)
InChIKeyTXCPELNEDXHRPW-UHFFFAOYSA-N
XLogP37.75
TPSA222.35 Ų
H-Bond Donors10
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms145
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002180.54
LogP ≤ 537.75
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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

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Related Compounds

3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole
CID 10257358
5-bromo-3-[5-(4-chlorophenyl)-4-phenyl-1H-imidazol-2-yl]-1H-indole
CID 11190117
3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole
CID 11454519
5-bromo-3-[5-(4-chlorophenyl)-4-(4-phenylphenyl)-1H-imidazol-2-yl]-1H-indole
CID 11386913
3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole
CID 11420291
3-[4,5-bis(1H-indol-3-yl)-1H-imidazol-2-yl]-5-bromo-1H-indole
CID 58882290
5-bromo-3-[5-(4-chlorocyclohexa-1,5-dien-1-yl)-4-(4-chlorophenyl)-1H-imidazol-2-yl]-1H-indole
CID 89277531
3-[[5-[(4-chlorophenyl)methyl]-4-[3-(1H-imidazol-5-yl)propyl]-1,2,4-triazol-3-yl]methyl]-6-[4-[[4-[3-(1H-imidazol-5-yl)propyl]-5-(1H-indol-3-ylmethyl)-1,2,4-triazol-3-yl]methyl]phenyl]-1H-indole
CID 142471977
5-bromo-3-[5-(4-chlorophenyl)-4-phenyl-1H-imidazol-2-yl]-1-methylindole
CID 143047805
3-[4,5-bis(4-phenylphenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;5-bromo-3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-1H-indole;3-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole
CID 157102092
2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen
CID 157131553
3-[4,5-bis(3-nitrophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-nitrophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;5-bromo-3-[5-(4-chlorophenyl)-4-phenyl-1H-imidazol-2-yl]-1H-indole;3-[5-(4-chlorophenyl)-4-phenyl-1H-imidazol-2-yl]-2-methyl-1H-indole;2-methyl-3-[5-(4-nitrophenyl)-4-phenyl-1H-imidazol-2-yl]-1H-indole
CID 157331905

Frequently Asked Questions

What is the IUPAC name of 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole?
The IUPAC name of 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole (CID 161011003) is 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole.
What is the SMILES notation for 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole?
The canonical SMILES for 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole is Cc1[nH]c2ccccc2c1-c1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)[nH]1.Cc1[nH]c2ccccc2c1-c1nc(-c2cccc(Cl)c2)c(-c2cccc(Cl)c2)[nH]1.Cc1ccc(-c2nc(-c3c(C)[nH]c4ccccc34)[nH]c2-c2ccc(C)cc2)cc1.Clc1ccc(-c2nc(-c3c[nH]c4ccc(Br)cc34)[nH]c2-c2ccc(Cl)cc2)cc1.Clc1cccc(-c2nc(-c3c[nH]c4ccc(Br)cc34)[nH]c2-c2cccc(Cl)c2)c1.
What is the InChIKey of 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole?
The InChIKey is TXCPELNEDXHRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3.2C24H17Cl2N3.2C23H14BrCl2N3/c1-16-8-12-19(13-9-16)24-25(20-14-10-17(2)11-15-20)29-26(28-24)23-18(3)27-22-7-5-4-6-21(22)23;1-14-21(19-10-2-3-11-20(19)27-14)24-28-22(15-6-4-8-17(25)12-15)23(29-24)16-7-5-9-18(26)13-16;1-14-21(19-4-2-3-5-20(19)27-14)24-28-22(15-6-10-17(25)11-7-15)23(29-24)16-8-12-18(26)13-9-16;24-15-5-10-20-18(11-15)19(12-27-20)23-28-21(13-1-6-16(25)7-2-13)22(29-23)14-3-8-17(26)9-4-14;24-15-7-8-20-18(11-15)19(12-27-20)23-28-21(13-3-1-5-16(25)9-13)22(29-23)14-4-2-6-17(26)10-14/h4-15,27H,1-3H3,(H,28,29);2*2-13,27H,1H3,(H,28,29);2*1-12,27H,(H,28,29).
What are the key properties of 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole?
3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole has a molecular weight of 2180.54 g/mol, XLogP of 37.75, 15 rotatable bonds, 10 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole;3-[4,5-bis(3-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole;3-[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]-2-methyl-1H-indole is sourced from PubChem (CID 161011003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).