2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one

C24H15N5O2 — CID 154657523

IUPAC2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESO=c1cc(-c2ccccc2)[nH]c2nc(-c3ccco3)c(-c3ccc4nc[nH]c4c3)nc12
InChIInChI=1S/C24H15N5O2/c30-19-12-17(14-5-2-1-3-6-14)27-24-22(19)28-21(23(29-24)20-7-4-10-31-20)15-8-9-16-18(11-15)26-13-25-16/h1-13H,(H,25,26)(H,27,29,30)
InChIKeyIYRYVPUZFWXRCN-UHFFFAOYSA-N
MW405.42 g/mol
LogP4.79
Rot. Bonds3

About 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one

2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one (PubChem CID 154657523) has the molecular formula C24H15N5O2 and a molecular weight of 405.42 g/mol. Its IUPAC name is 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one.

Molecular Properties

Compound Name2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
PubChem CID154657523
Molecular FormulaC24H15N5O2
Molecular Weight405.42 g/mol
Exact Mass405.12
IUPAC Name2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESO=c1cc(-c2ccccc2)[nH]c2nc(-c3ccco3)c(-c3ccc4nc[nH]c4c3)nc12
InChIInChI=1S/C24H15N5O2/c30-19-12-17(14-5-2-1-3-6-14)27-24-22(19)28-21(23(29-24)20-7-4-10-31-20)15-8-9-16-18(11-15)26-13-25-16/h1-13H,(H,25,26)(H,27,29,30)
InChIKeyIYRYVPUZFWXRCN-UHFFFAOYSA-N
XLogP4.79
TPSA100.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.42
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The IUPAC name of 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one (CID 154657523) is 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one.
What is the SMILES notation for 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The canonical SMILES for 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one is O=c1cc(-c2ccccc2)[nH]c2nc(-c3ccco3)c(-c3ccc4nc[nH]c4c3)nc12.
What is the InChIKey of 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The InChIKey is IYRYVPUZFWXRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15N5O2/c30-19-12-17(14-5-2-1-3-6-14)27-24-22(19)28-21(23(29-24)20-7-4-10-31-20)15-8-9-16-18(11-15)26-13-25-16/h1-13H,(H,25,26)(H,27,29,30).
What are the key properties of 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one has a molecular weight of 405.42 g/mol, XLogP of 4.79, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3H-benzimidazol-5-yl)-3-(furan-2-yl)-6-phenyl-5H-pyrido[2,3-b]pyrazin-8-one is sourced from PubChem (CID 154657523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).