(4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole

C27H21FN2 — CID 135049713

IUPAC(4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole
SMILESFc1ccccc1C1=N[C@H](c2ccccc2)[C@@H](c2ccccc2)N1c1ccccc1
InChIInChI=1S/C27H21FN2/c28-24-19-11-10-18-23(24)27-29-25(20-12-4-1-5-13-20)26(21-14-6-2-7-15-21)30(27)22-16-8-3-9-17-22/h1-19,25-26H/t25-,26-/m1/s1
InChIKeyUSDSYEKLDYCKQZ-CLJLJLNGSA-N
MW392.48 g/mol
LogP6.58
Rot. Bonds4

About (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole

(4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole (PubChem CID 135049713) has the molecular formula C27H21FN2 and a molecular weight of 392.48 g/mol. Its IUPAC name is (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name(4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole
PubChem CID135049713
Molecular FormulaC27H21FN2
Molecular Weight392.48 g/mol
Exact Mass392.17
IUPAC Name(4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole
SMILESFc1ccccc1C1=N[C@H](c2ccccc2)[C@@H](c2ccccc2)N1c1ccccc1
InChIInChI=1S/C27H21FN2/c28-24-19-11-10-18-23(24)27-29-25(20-12-4-1-5-13-20)26(21-14-6-2-7-15-21)30(27)22-16-8-3-9-17-22/h1-19,25-26H/t25-,26-/m1/s1
InChIKeyUSDSYEKLDYCKQZ-CLJLJLNGSA-N
XLogP6.58
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.48
LogP ≤ 56.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole 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,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole?
The IUPAC name of (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole (CID 135049713) is (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole.
What is the SMILES notation for (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole?
The canonical SMILES for (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole is Fc1ccccc1C1=N[C@H](c2ccccc2)[C@@H](c2ccccc2)N1c1ccccc1.
What is the InChIKey of (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole?
The InChIKey is USDSYEKLDYCKQZ-CLJLJLNGSA-N. The full InChI is InChI=1S/C27H21FN2/c28-24-19-11-10-18-23(24)27-29-25(20-12-4-1-5-13-20)26(21-14-6-2-7-15-21)30(27)22-16-8-3-9-17-22/h1-19,25-26H/t25-,26-/m1/s1.
What are the key properties of (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole?
(4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole has a molecular weight of 392.48 g/mol, XLogP of 6.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-2-(2-fluorophenyl)-1,4,5-triphenyl-4,5-dihydroimidazole is sourced from PubChem (CID 135049713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).