1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one

C24H19FN4O2 — CID 118937570

IUPAC1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one
SMILESO=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)c1ccccc1
InChIInChI=1S/C24H19FN4O2/c25-19-9-4-5-10-22(19)29-21-12-6-11-20(18(21)15-26-29)28-14-13-27(24(28)31)16-23(30)17-7-2-1-3-8-17/h1-12,15H,13-14,16H2
InChIKeyBYNKRVMNNXNNAS-UHFFFAOYSA-N
MW414.44 g/mol
LogP4.29
Rot. Bonds5

About 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one

1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one (PubChem CID 118937570) has the molecular formula C24H19FN4O2 and a molecular weight of 414.44 g/mol. Its IUPAC name is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one
PubChem CID118937570
Molecular FormulaC24H19FN4O2
Molecular Weight414.44 g/mol
Exact Mass414.15
IUPAC Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one
SMILESO=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)c1ccccc1
InChIInChI=1S/C24H19FN4O2/c25-19-9-4-5-10-22(19)29-21-12-6-11-20(18(21)15-26-29)28-14-13-27(24(28)31)16-23(30)17-7-2-1-3-8-17/h1-12,15H,13-14,16H2
InChIKeyBYNKRVMNNXNNAS-UHFFFAOYSA-N
XLogP4.29
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.44
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one 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 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one?
The IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one (CID 118937570) is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one.
What is the SMILES notation for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one?
The canonical SMILES for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one is O=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)c1ccccc1.
What is the InChIKey of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one?
The InChIKey is BYNKRVMNNXNNAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN4O2/c25-19-9-4-5-10-22(19)29-21-12-6-11-20(18(21)15-26-29)28-14-13-27(24(28)31)16-23(30)17-7-2-1-3-8-17/h1-12,15H,13-14,16H2.
What are the key properties of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one?
1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one has a molecular weight of 414.44 g/mol, XLogP of 4.29, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-phenacylimidazolidin-2-one is sourced from PubChem (CID 118937570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).