(4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole

C21H18N2 — CID 2818099

IUPAC(4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole
SMILESc1ccc(C2=N[C@H](c3ccccc3)[C@H](c3ccccc3)N2)cc1
InChIInChI=1S/C21H18N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-15,19-20H,(H,22,23)/t19-,20+
InChIKeyUCCFUHZMGXEALP-BGYRXZFFSA-N
MW298.39 g/mol
LogP4.52
Rot. Bonds3

About (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole

(4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole (PubChem CID 2818099) has the molecular formula C21H18N2 and a molecular weight of 298.39 g/mol. Its IUPAC name is (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name(4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole
PubChem CID2818099
Molecular FormulaC21H18N2
Molecular Weight298.39 g/mol
Exact Mass298.15
IUPAC Name(4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole
SMILESc1ccc(C2=N[C@H](c3ccccc3)[C@H](c3ccccc3)N2)cc1
InChIInChI=1S/C21H18N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-15,19-20H,(H,22,23)/t19-,20+
InChIKeyUCCFUHZMGXEALP-BGYRXZFFSA-N
XLogP4.52
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole?
The IUPAC name of (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole (CID 2818099) is (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole?
The canonical SMILES for (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole is c1ccc(C2=N[C@H](c3ccccc3)[C@H](c3ccccc3)N2)cc1.
What is the InChIKey of (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole?
The InChIKey is UCCFUHZMGXEALP-BGYRXZFFSA-N. The full InChI is InChI=1S/C21H18N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-15,19-20H,(H,22,23)/t19-,20+.
What are the key properties of (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole?
(4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole has a molecular weight of 298.39 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5S)-2,4,5-triphenyl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 2818099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).