1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole

C21H18N2S — CID 122227297

IUPAC1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole
SMILESCCn1c(-c2ccccc2)nc(-c2ccccc2)c1-c1cccs1
InChIInChI=1S/C21H18N2S/c1-2-23-20(18-14-9-15-24-18)19(16-10-5-3-6-11-16)22-21(23)17-12-7-4-8-13-17/h3-15H,2H2,1H3
InChIKeyZAEUZYCULNFTBA-UHFFFAOYSA-N
MW330.46 g/mol
LogP5.97
Rot. Bonds4

About 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole

1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole (PubChem CID 122227297) has the molecular formula C21H18N2S and a molecular weight of 330.46 g/mol. Its IUPAC name is 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole.

Molecular Properties

Compound Name1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole
PubChem CID122227297
Molecular FormulaC21H18N2S
Molecular Weight330.46 g/mol
Exact Mass330.12
IUPAC Name1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole
SMILESCCn1c(-c2ccccc2)nc(-c2ccccc2)c1-c1cccs1
InChIInChI=1S/C21H18N2S/c1-2-23-20(18-14-9-15-24-18)19(16-10-5-3-6-11-16)22-21(23)17-12-7-4-8-13-17/h3-15H,2H2,1H3
InChIKeyZAEUZYCULNFTBA-UHFFFAOYSA-N
XLogP5.97
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.46
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenyl)-1-ethyl-4,5-diphenylimidazole
CID 11825610
1-ethyl-3-thiophen-2-ylquinoxalin-2-one
CID 90202221
2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole
CID 20577238
4-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-thiophen-2-yl-1,3-oxazole
CID 7625422
1-methyl-2-[4-(1-methyl-4,5-diphenylimidazol-2-yl)phenyl]-4,5-diphenylimidazole
CID 102256803
3-ethyl-2-phenylquinazolin-4-one
CID 12626608
4,5-diphenyl-1-[(2S)-1-phenyl-3-phenylsulfanylpropan-2-yl]-2-thiophen-2-ylimidazole
CID 139086250
3-[4-[1-butyl-5-[4-(2-carboxyethenyl)phenyl]-2-thiophen-2-ylimidazol-4-yl]phenyl]prop-2-enoic acid
CID 85154728
3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine
CID 62222262
2-(4-oxo-2-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)acetic acid
CID 28898565
6-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]phenanthridine
CID 18266812
1-ethyl-5-thiophen-2-yltriazole-4-carboxylic acid
CID 82207138

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole?
The IUPAC name of 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole (CID 122227297) is 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole.
What is the SMILES notation for 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole?
The canonical SMILES for 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole is CCn1c(-c2ccccc2)nc(-c2ccccc2)c1-c1cccs1.
What is the InChIKey of 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole?
The InChIKey is ZAEUZYCULNFTBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2S/c1-2-23-20(18-14-9-15-24-18)19(16-10-5-3-6-11-16)22-21(23)17-12-7-4-8-13-17/h3-15H,2H2,1H3.
What are the key properties of 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole?
1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole has a molecular weight of 330.46 g/mol, XLogP of 5.97, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole is sourced from PubChem (CID 122227297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).