2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one

C23H17N5O — CID 22724344

IUPAC2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one
SMILESO=c1c(Cn2ccnc2)nc2cccnc2n1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C23H17N5O/c29-23-21(15-27-13-12-24-16-27)26-20-10-5-11-25-22(20)28(23)19-9-4-8-18(14-19)17-6-2-1-3-7-17/h1-14,16H,15H2
InChIKeyHKRPQGUOYFVPJG-UHFFFAOYSA-N
MW379.42 g/mol
LogP3.69
Rot. Bonds4

About 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one

2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one (PubChem CID 22724344) has the molecular formula C23H17N5O and a molecular weight of 379.42 g/mol. Its IUPAC name is 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one.

Molecular Properties

Compound Name2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one
PubChem CID22724344
Molecular FormulaC23H17N5O
Molecular Weight379.42 g/mol
Exact Mass379.14
IUPAC Name2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one
SMILESO=c1c(Cn2ccnc2)nc2cccnc2n1-c1cccc(-c2ccccc2)c1
InChIInChI=1S/C23H17N5O/c29-23-21(15-27-13-12-24-16-27)26-20-10-5-11-25-22(20)28(23)19-9-4-8-18(14-19)17-6-2-1-3-7-17/h1-14,16H,15H2
InChIKeyHKRPQGUOYFVPJG-UHFFFAOYSA-N
XLogP3.69
TPSA65.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one?
The IUPAC name of 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one (CID 22724344) is 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one.
What is the SMILES notation for 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one?
The canonical SMILES for 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one is O=c1c(Cn2ccnc2)nc2cccnc2n1-c1cccc(-c2ccccc2)c1.
What is the InChIKey of 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one?
The InChIKey is HKRPQGUOYFVPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N5O/c29-23-21(15-27-13-12-24-16-27)26-20-10-5-11-25-22(20)28(23)19-9-4-8-18(14-19)17-6-2-1-3-7-17/h1-14,16H,15H2.
What are the key properties of 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one?
2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one has a molecular weight of 379.42 g/mol, XLogP of 3.69, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazol-1-ylmethyl)-4-(3-phenylphenyl)pyrido[2,3-b]pyrazin-3-one is sourced from PubChem (CID 22724344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).