5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole

C20H20F2N2O2 — CID 50966339

IUPAC5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole
SMILESCOC[C@H](C)n1cnc(-c2ccccc2)c1-c1cc(F)c(OC)c(F)c1
InChIInChI=1S/C20H20F2N2O2/c1-13(11-25-2)24-12-23-18(14-7-5-4-6-8-14)19(24)15-9-16(21)20(26-3)17(22)10-15/h4-10,12-13H,11H2,1-3H3/t13-/m0/s1
InChIKeyKGCTWXFDDTZXDW-ZDUSSCGKSA-N
MW358.39 g/mol
LogP4.71
Rot. Bonds6

About 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole

5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole (PubChem CID 50966339) has the molecular formula C20H20F2N2O2 and a molecular weight of 358.39 g/mol. Its IUPAC name is 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole.

Molecular Properties

Compound Name5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole
PubChem CID50966339
Molecular FormulaC20H20F2N2O2
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC Name5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole
SMILESCOC[C@H](C)n1cnc(-c2ccccc2)c1-c1cc(F)c(OC)c(F)c1
InChIInChI=1S/C20H20F2N2O2/c1-13(11-25-2)24-12-23-18(14-7-5-4-6-8-14)19(24)15-9-16(21)20(26-3)17(22)10-15/h4-10,12-13H,11H2,1-3H3/t13-/m0/s1
InChIKeyKGCTWXFDDTZXDW-ZDUSSCGKSA-N
XLogP4.71
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-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

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole?
The IUPAC name of 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole (CID 50966339) is 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole.
What is the SMILES notation for 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole?
The canonical SMILES for 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole is COC[C@H](C)n1cnc(-c2ccccc2)c1-c1cc(F)c(OC)c(F)c1.
What is the InChIKey of 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole?
The InChIKey is KGCTWXFDDTZXDW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C20H20F2N2O2/c1-13(11-25-2)24-12-23-18(14-7-5-4-6-8-14)19(24)15-9-16(21)20(26-3)17(22)10-15/h4-10,12-13H,11H2,1-3H3/t13-/m0/s1.
What are the key properties of 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole?
5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole has a molecular weight of 358.39 g/mol, XLogP of 4.71, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-difluoro-4-methoxyphenyl)-1-[(2S)-1-methoxypropan-2-yl]-4-phenylimidazole is sourced from PubChem (CID 50966339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).