5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole

C20H24N2O3S — CID 95137551

IUPAC5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole
SMILESCc1ccc([C@@H](C)Cc2c(-c3ccccc3)ncn2CCS(C)(=O)=O)o1
InChIInChI=1S/C20H24N2O3S/c1-15(19-10-9-16(2)25-19)13-18-20(17-7-5-4-6-8-17)21-14-22(18)11-12-26(3,23)24/h4-10,14-15H,11-13H2,1-3H3/t15-/m0/s1
InChIKeyXGILLUGNHBDJHP-HNNXBMFYSA-N
MW372.49 g/mol
LogP3.84
Rot. Bonds7

About 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole

5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole (PubChem CID 95137551) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole.

Molecular Properties

Compound Name5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole
PubChem CID95137551
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC Name5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole
SMILESCc1ccc([C@@H](C)Cc2c(-c3ccccc3)ncn2CCS(C)(=O)=O)o1
InChIInChI=1S/C20H24N2O3S/c1-15(19-10-9-16(2)25-19)13-18-20(17-7-5-4-6-8-17)21-14-22(18)11-12-26(3,23)24/h4-10,14-15H,11-13H2,1-3H3/t15-/m0/s1
InChIKeyXGILLUGNHBDJHP-HNNXBMFYSA-N
XLogP3.84
TPSA65.10 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[5-[(2R)-2-(5-methylfuran-2-yl)propyl]-4-phenylimidazol-1-yl]ethoxy]ethanol
CID 95135611
1-(2-methylsulfonylethyl)-5-[(2R)-pentan-2-yl]-4-phenylimidazole
CID 95135192
1-(2-methylsulfonylethyl)-4-phenyl-5-spiro[2.2]pentan-2-ylimidazole
CID 154843244
1-[2-[5-[(2R)-2-methylsulfanylpropyl]-4-phenylimidazol-1-yl]ethyl]piperidine
CID 95142744
5-(2-fluoro-3-methoxyphenyl)-1-(2-methylsulfonylethyl)-4-phenylimidazole
CID 50980699
4-(4-methoxyphenyl)-1-[2-(2-methoxyphenyl)ethyl]-5-(2-methylpropyl)imidazole
CID 51049955
1-[3-[[3-[(methyl-methylidene-oxo-λ6-sulfanyl)methyl]phenyl]methyl]-5-phenylimidazol-4-yl]propan-2-ol
CID 157184739
2-(2-methylsulfonylethyl)-5,6-diphenyl-1,2,4-triazin-3-one
CID 47073572
1-[2-(1-methylimidazol-2-yl)sulfanylethyl]-5-(2-methylpropyl)-4-phenylimidazole
CID 50973243
3-(2-methylpropyl)-5-phenylimidazol-4-amine
CID 62017938
1-(2-methylsulfonylethyl)-3-phenylpyrazole
CID 66015946
5-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]-1,3,4-thiadiazol-2-amine
CID 50960079

Frequently Asked Questions

What is the IUPAC name of 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole?
The IUPAC name of 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole (CID 95137551) is 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole.
What is the SMILES notation for 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole?
The canonical SMILES for 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole is Cc1ccc([C@@H](C)Cc2c(-c3ccccc3)ncn2CCS(C)(=O)=O)o1.
What is the InChIKey of 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole?
The InChIKey is XGILLUGNHBDJHP-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-15(19-10-9-16(2)25-19)13-18-20(17-7-5-4-6-8-17)21-14-22(18)11-12-26(3,23)24/h4-10,14-15H,11-13H2,1-3H3/t15-/m0/s1.
What are the key properties of 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole?
5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole has a molecular weight of 372.49 g/mol, XLogP of 3.84, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2S)-2-(5-methylfuran-2-yl)propyl]-1-(2-methylsulfonylethyl)-4-phenylimidazole is sourced from PubChem (CID 95137551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).