4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole

C89H66N10S5 — CID 157496266

IUPAC4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole
SMILESCc1[nH]c(-c2cccs2)nc1-c1ccc2ccccc2c1.Cc1[nH]c(-c2cccs2)nc1-c1cccc2ccccc12.c1ccc(-c2nc(-c3cccs3)[nH]c2-c2ccccc2)cc1.c1csc(-c2ncc(-c3ccc4ccccc4c3)[nH]2)c1.c1csc(-c2ncc(-c3cccc4ccccc34)[nH]2)c1
InChIInChI=1S/C19H14N2S.2C18H14N2S.2C17H12N2S/c1-3-8-14(9-4-1)17-18(15-10-5-2-6-11-15)21-19(20-17)16-12-7-13-22-16;1-12-17(20-18(19-12)16-10-5-11-21-16)15-9-4-7-13-6-2-3-8-14(13)15;1-12-17(20-18(19-12)16-7-4-10-21-16)15-9-8-13-5-2-3-6-14(13)11-15;1-2-7-13-12(5-1)6-3-8-14(13)15-11-18-17(19-15)16-9-4-10-20-16;1-2-5-13-10-14(8-7-12(13)4-1)15-11-18-17(19-15)16-6-3-9-20-16/h1-13H,(H,20,21);2*2-11H,1H3,(H,19,20);2*1-11H,(H,18,19)
InChIKeyBXWFWATZMHFEEF-UHFFFAOYSA-N
MW1435.91 g/mol
LogP25.92
Rot. Bonds11

About 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole

4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole (PubChem CID 157496266) has the molecular formula C89H66N10S5 and a molecular weight of 1435.91 g/mol. Its IUPAC name is 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole.

Molecular Properties

Compound Name4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole
PubChem CID157496266
Molecular FormulaC89H66N10S5
Molecular Weight1435.91 g/mol
Exact Mass1434.41
IUPAC Name4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole
SMILESCc1[nH]c(-c2cccs2)nc1-c1ccc2ccccc2c1.Cc1[nH]c(-c2cccs2)nc1-c1cccc2ccccc12.c1ccc(-c2nc(-c3cccs3)[nH]c2-c2ccccc2)cc1.c1csc(-c2ncc(-c3ccc4ccccc4c3)[nH]2)c1.c1csc(-c2ncc(-c3cccc4ccccc34)[nH]2)c1
InChIInChI=1S/C19H14N2S.2C18H14N2S.2C17H12N2S/c1-3-8-14(9-4-1)17-18(15-10-5-2-6-11-15)21-19(20-17)16-12-7-13-22-16;1-12-17(20-18(19-12)16-10-5-11-21-16)15-9-4-7-13-6-2-3-8-14(13)15;1-12-17(20-18(19-12)16-7-4-10-21-16)15-9-8-13-5-2-3-6-14(13)11-15;1-2-7-13-12(5-1)6-3-8-14(13)15-11-18-17(19-15)16-9-4-10-20-16;1-2-5-13-10-14(8-7-12(13)4-1)15-11-18-17(19-15)16-6-3-9-20-16/h1-13H,(H,20,21);2*2-11H,1H3,(H,19,20);2*1-11H,(H,18,19)
InChIKeyBXWFWATZMHFEEF-UHFFFAOYSA-N
XLogP25.92
TPSA143.40 Ų
H-Bond Donors5
H-Bond Acceptors10
Rotatable Bonds11
Heavy Atoms104
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001435.91
LogP ≤ 525.92
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole?
The IUPAC name of 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole (CID 157496266) is 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole.
What is the SMILES notation for 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole?
The canonical SMILES for 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole is Cc1[nH]c(-c2cccs2)nc1-c1ccc2ccccc2c1.Cc1[nH]c(-c2cccs2)nc1-c1cccc2ccccc12.c1ccc(-c2nc(-c3cccs3)[nH]c2-c2ccccc2)cc1.c1csc(-c2ncc(-c3ccc4ccccc4c3)[nH]2)c1.c1csc(-c2ncc(-c3cccc4ccccc34)[nH]2)c1.
What is the InChIKey of 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole?
The InChIKey is BXWFWATZMHFEEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2S.2C18H14N2S.2C17H12N2S/c1-3-8-14(9-4-1)17-18(15-10-5-2-6-11-15)21-19(20-17)16-12-7-13-22-16;1-12-17(20-18(19-12)16-10-5-11-21-16)15-9-4-7-13-6-2-3-8-14(13)15;1-12-17(20-18(19-12)16-7-4-10-21-16)15-9-8-13-5-2-3-6-14(13)11-15;1-2-7-13-12(5-1)6-3-8-14(13)15-11-18-17(19-15)16-9-4-10-20-16;1-2-5-13-10-14(8-7-12(13)4-1)15-11-18-17(19-15)16-6-3-9-20-16/h1-13H,(H,20,21);2*2-11H,1H3,(H,19,20);2*1-11H,(H,18,19).
What are the key properties of 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole?
4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole has a molecular weight of 1435.91 g/mol, XLogP of 25.92, 11 rotatable bonds, 5 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-diphenyl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-methyl-4-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-1-yl-2-thiophen-2-yl-1H-imidazole;5-naphthalen-2-yl-2-thiophen-2-yl-1H-imidazole is sourced from PubChem (CID 157496266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).