7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one

C27H17N5O2 — CID 154656825

IUPAC7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESO=c1cccc(-c2cc3nc(-c4ccc5ncccc5c4)c(-c4ccccc4)nc3[nH]c2=O)[nH]1
InChIInChI=1S/C27H17N5O2/c33-23-10-4-9-21(29-23)19-15-22-26(32-27(19)34)31-24(16-6-2-1-3-7-16)25(30-22)18-11-12-20-17(14-18)8-5-13-28-20/h1-15H,(H,29,33)(H,31,32,34)
InChIKeyFCIGFCYFCRMBRM-UHFFFAOYSA-N
MW443.47 g/mol
LogP4.56
Rot. Bonds3

About 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one

7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one (PubChem CID 154656825) has the molecular formula C27H17N5O2 and a molecular weight of 443.47 g/mol. Its IUPAC name is 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
PubChem CID154656825
Molecular FormulaC27H17N5O2
Molecular Weight443.47 g/mol
Exact Mass443.14
IUPAC Name7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESO=c1cccc(-c2cc3nc(-c4ccc5ncccc5c4)c(-c4ccccc4)nc3[nH]c2=O)[nH]1
InChIInChI=1S/C27H17N5O2/c33-23-10-4-9-21(29-23)19-15-22-26(32-27(19)34)31-24(16-6-2-1-3-7-16)25(30-22)18-11-12-20-17(14-18)8-5-13-28-20/h1-15H,(H,29,33)(H,31,32,34)
InChIKeyFCIGFCYFCRMBRM-UHFFFAOYSA-N
XLogP4.56
TPSA104.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms34
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.47
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The IUPAC name of 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one (CID 154656825) is 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one.
What is the SMILES notation for 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The canonical SMILES for 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one is O=c1cccc(-c2cc3nc(-c4ccc5ncccc5c4)c(-c4ccccc4)nc3[nH]c2=O)[nH]1.
What is the InChIKey of 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The InChIKey is FCIGFCYFCRMBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17N5O2/c33-23-10-4-9-21(29-23)19-15-22-26(32-27(19)34)31-24(16-6-2-1-3-7-16)25(30-22)18-11-12-20-17(14-18)8-5-13-28-20/h1-15H,(H,29,33)(H,31,32,34).
What are the key properties of 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one has a molecular weight of 443.47 g/mol, XLogP of 4.56, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one is sourced from PubChem (CID 154656825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).