7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one

C18H12ClN3O — CID 53036431

IUPAC7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one
SMILESO=c1c2nc(-c3ccccc3)cn2ccn1-c1cccc(Cl)c1
InChIInChI=1S/C18H12ClN3O/c19-14-7-4-8-15(11-14)22-10-9-21-12-16(20-17(21)18(22)23)13-5-2-1-3-6-13/h1-12H
InChIKeyZFQQCRYXVBUVDX-UHFFFAOYSA-N
MW321.77 g/mol
LogP3.81
Rot. Bonds2

About 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one

7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one (PubChem CID 53036431) has the molecular formula C18H12ClN3O and a molecular weight of 321.77 g/mol. Its IUPAC name is 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one.

Molecular Properties

Compound Name7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one
PubChem CID53036431
Molecular FormulaC18H12ClN3O
Molecular Weight321.77 g/mol
Exact Mass321.07
IUPAC Name7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one
SMILESO=c1c2nc(-c3ccccc3)cn2ccn1-c1cccc(Cl)c1
InChIInChI=1S/C18H12ClN3O/c19-14-7-4-8-15(11-14)22-10-9-21-12-16(20-17(21)18(22)23)13-5-2-1-3-6-13/h1-12H
InChIKeyZFQQCRYXVBUVDX-UHFFFAOYSA-N
XLogP3.81
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.77
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one?
The IUPAC name of 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one (CID 53036431) is 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one.
What is the SMILES notation for 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one?
The canonical SMILES for 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one is O=c1c2nc(-c3ccccc3)cn2ccn1-c1cccc(Cl)c1.
What is the InChIKey of 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one?
The InChIKey is ZFQQCRYXVBUVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClN3O/c19-14-7-4-8-15(11-14)22-10-9-21-12-16(20-17(21)18(22)23)13-5-2-1-3-6-13/h1-12H.
What are the key properties of 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one?
7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one has a molecular weight of 321.77 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-chlorophenyl)-2-phenylimidazo[1,2-a]pyrazin-8-one is sourced from PubChem (CID 53036431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).