6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione

C13H7BrClFN2O2 — CID 118598708

IUPAC6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione
SMILESO=C1NC(c2cccc(F)c2)n2c1c(Cl)cc(Br)c2=O
InChIInChI=1S/C13H7BrClFN2O2/c14-8-5-9(15)10-12(19)17-11(18(10)13(8)20)6-2-1-3-7(16)4-6/h1-5,11H,(H,17,19)
InChIKeyHMCACCAOWYBKTB-UHFFFAOYSA-N
MW357.57 g/mol
LogP2.69
Rot. Bonds1

About 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione

6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione (PubChem CID 118598708) has the molecular formula C13H7BrClFN2O2 and a molecular weight of 357.57 g/mol. Its IUPAC name is 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione.

Molecular Properties

Compound Name6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione
PubChem CID118598708
Molecular FormulaC13H7BrClFN2O2
Molecular Weight357.57 g/mol
Exact Mass355.94
IUPAC Name6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione
SMILESO=C1NC(c2cccc(F)c2)n2c1c(Cl)cc(Br)c2=O
InChIInChI=1S/C13H7BrClFN2O2/c14-8-5-9(15)10-12(19)17-11(18(10)13(8)20)6-2-1-3-7(16)4-6/h1-5,11H,(H,17,19)
InChIKeyHMCACCAOWYBKTB-UHFFFAOYSA-N
XLogP2.69
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.57
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione 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 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione?
The IUPAC name of 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione (CID 118598708) is 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione.
What is the SMILES notation for 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione?
The canonical SMILES for 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione is O=C1NC(c2cccc(F)c2)n2c1c(Cl)cc(Br)c2=O.
What is the InChIKey of 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione?
The InChIKey is HMCACCAOWYBKTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7BrClFN2O2/c14-8-5-9(15)10-12(19)17-11(18(10)13(8)20)6-2-1-3-7(16)4-6/h1-5,11H,(H,17,19).
What are the key properties of 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione?
6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione has a molecular weight of 357.57 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-chloro-3-(3-fluorophenyl)-2,3-dihydroimidazo[1,5-a]pyridine-1,5-dione is sourced from PubChem (CID 118598708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).