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

C26H17N5O2S — CID 154656404

IUPAC3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3nc2-c2ccc3ncccc3c2)s1
InChIInChI=1S/C26H17N5O2S/c1-15-7-10-21(34-15)24-23(17-8-9-18-16(13-17)5-4-11-27-18)28-19-14-20(26(33)30-25(19)29-24)31-12-3-2-6-22(31)32/h2-14H,1H3,(H,29,30,33)
InChIKeyGITHDGZSBLKWFP-UHFFFAOYSA-N
MW463.52 g/mol
LogP4.72
Rot. Bonds3

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

3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one (PubChem CID 154656404) has the molecular formula C26H17N5O2S and a molecular weight of 463.52 g/mol. Its IUPAC name is 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
PubChem CID154656404
Molecular FormulaC26H17N5O2S
Molecular Weight463.52 g/mol
Exact Mass463.11
IUPAC Name3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3nc2-c2ccc3ncccc3c2)s1
InChIInChI=1S/C26H17N5O2S/c1-15-7-10-21(34-15)24-23(17-8-9-18-16(13-17)5-4-11-27-18)28-19-14-20(26(33)30-25(19)29-24)31-12-3-2-6-22(31)32/h2-14H,1H3,(H,29,30,33)
InChIKeyGITHDGZSBLKWFP-UHFFFAOYSA-N
XLogP4.72
TPSA93.53 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.52
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one with MolForge

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Launch Full Analysis

Related Compounds

3-(5-methylthiophen-2-yl)-7-pyrimidin-5-yl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154657489
6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154656740
7-(5-methylthiophen-2-yl)-3-morpholin-4-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
CID 137438139
7-(6-oxo-1H-pyridin-2-yl)-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154656825
7-(5-methylthiophen-2-yl)-2-oxo-6-quinolin-6-yl-1H-1,8-naphthyridine-4-carboxamide
CID 137438841
7-[2-(diethylamino)ethylamino]-3-(2-methyl-1,3-thiazol-5-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154657593
3-hydroxy-7-(2-methyl-1,3-thiazol-5-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
CID 137438827
N-benzyl-7-(5-methylthiophen-2-yl)-4-oxo-6-quinolin-6-yl-1H-1,8-naphthyridine-2-carboxamide
CID 137438794
7-(5-methylthiophen-2-yl)-2-(3-phenylpropanoyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 153147691
3-methyl-7-(5-methylfuran-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
CID 137438814
6-(5-methylthiophen-2-yl)-2-(quinolin-6-ylmethyl)pyridazin-3-one
CID 166219828
3-(2-methyl-1H-imidazol-5-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657357

Frequently Asked Questions

What is the IUPAC name of 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The IUPAC name of 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one (CID 154656404) is 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one.
What is the SMILES notation for 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The canonical SMILES for 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one is Cc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3nc2-c2ccc3ncccc3c2)s1.
What is the InChIKey of 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The InChIKey is GITHDGZSBLKWFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17N5O2S/c1-15-7-10-21(34-15)24-23(17-8-9-18-16(13-17)5-4-11-27-18)28-19-14-20(26(33)30-25(19)29-24)31-12-3-2-6-22(31)32/h2-14H,1H3,(H,29,30,33).
What are the key properties of 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one?
3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one has a molecular weight of 463.52 g/mol, XLogP of 4.72, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one is sourced from PubChem (CID 154656404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).