1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione

C24H20FN5S — CID 133182350

IUPAC1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione
SMILESCc1ccc(-n2cccc2C2C(c3ccccn3)NC(=S)N2c2ccccc2F)nc1
InChIInChI=1S/C24H20FN5S/c1-16-11-12-21(27-15-16)29-14-6-10-20(29)23-22(18-8-4-5-13-26-18)28-24(31)30(23)19-9-3-2-7-17(19)25/h2-15,22-23H,1H3,(H,28,31)
InChIKeySLCZFWDWEVEACV-UHFFFAOYSA-N
MW429.52 g/mol
LogP4.89
Rot. Bonds4

About 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione

1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione (PubChem CID 133182350) has the molecular formula C24H20FN5S and a molecular weight of 429.52 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione.

Molecular Properties

Compound Name1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione
PubChem CID133182350
Molecular FormulaC24H20FN5S
Molecular Weight429.52 g/mol
Exact Mass429.14
IUPAC Name1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione
SMILESCc1ccc(-n2cccc2C2C(c3ccccn3)NC(=S)N2c2ccccc2F)nc1
InChIInChI=1S/C24H20FN5S/c1-16-11-12-21(27-15-16)29-14-6-10-20(29)23-22(18-8-4-5-13-26-18)28-24(31)30(23)19-9-3-2-7-17(19)25/h2-15,22-23H,1H3,(H,28,31)
InChIKeySLCZFWDWEVEACV-UHFFFAOYSA-N
XLogP4.89
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.52
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione 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

1-(2-fluorophenyl)-5-[1-(4-hydroxyphenyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione
CID 133182440
N-(2-fluorophenyl)-3-[(4S,5R)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-yl-2-sulfanylideneimidazolidin-1-yl]propanamide
CID 100695714
1-(2-fluorophenyl)-4-pyridin-2-yl-5-[1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]imidazolidine-2-thione
CID 133182432
1-(4-methylphenyl)-5-(1-phenylpyrrol-2-yl)-4-pyridin-2-ylimidazolidine-2-thione
CID 133157895
2-[(4R,5R)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-yl-2-sulfanylideneimidazolidin-1-yl]-N-phenylacetamide
CID 100656309
1-(4-chlorophenyl)-5-[1-(4-methylphenyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione
CID 133182587
1-(furan-2-ylmethyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione
CID 133223712
1-(4-bromo-3-methylphenyl)-5-[1-(2-fluorophenyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione
CID 133224365
N-[4-[(4R,5S)-5-[1-(2-fluorophenyl)pyrrol-2-yl]-4-pyridin-2-yl-2-sulfanylideneimidazolidin-1-yl]phenyl]methanesulfonamide
CID 100617982
5-[1-(2-methoxyphenyl)pyrrol-2-yl]-1-(4-methylphenyl)-4-pyridin-2-ylimidazolidine-2-thione
CID 133157824
5-[1-(5-chloro-2-pyridinyl)pyrrol-2-yl]-1-[4-(dimethylamino)phenyl]-4-pyridin-2-ylimidazolidine-2-thione
CID 133156560
N-[2-methoxy-4-[(4R,5R)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-yl-2-sulfanylideneimidazolidin-1-yl]phenyl]-2,2-dimethylpropanamide
CID 100541497

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione?
The IUPAC name of 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione (CID 133182350) is 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione.
What is the SMILES notation for 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione?
The canonical SMILES for 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione is Cc1ccc(-n2cccc2C2C(c3ccccn3)NC(=S)N2c2ccccc2F)nc1.
What is the InChIKey of 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione?
The InChIKey is SLCZFWDWEVEACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN5S/c1-16-11-12-21(27-15-16)29-14-6-10-20(29)23-22(18-8-4-5-13-26-18)28-24(31)30(23)19-9-3-2-7-17(19)25/h2-15,22-23H,1H3,(H,28,31).
What are the key properties of 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione?
1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione has a molecular weight of 429.52 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-5-[1-(5-methyl-2-pyridinyl)pyrrol-2-yl]-4-pyridin-2-ylimidazolidine-2-thione is sourced from PubChem (CID 133182350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).