7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one

C105H69N19O7S3 — CID 160551284

IUPAC7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
SMILESCc1ccc(-c2nc3[nH]c(=O)c(-c4cncnc4)cc3cc2-c2ccc3ncccc3c2)s1.Cc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3cc2-c2ccc3ncccc3c2)o1.Cc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3cc2-c2ccc3ncccc3c2)s1.Cc1ncc(-c2nc3[nH]c(=O)c(-c4cncnc4)cc3cc2-c2ccc3ncccc3c2)s1
InChIInChI=1S/C27H18N4O3.C27H18N4O2S.C26H17N5OS.C25H16N6OS/c2*1-16-7-10-23(34-16)25-20(17-8-9-21-18(13-17)5-4-11-28-21)14-19-15-22(27(33)30-26(19)29-25)31-12-3-2-6-24(31)32;1-15-4-7-23(33-15)24-20(16-5-6-22-17(9-16)3-2-8-29-22)10-18-11-21(19-12-27-14-28-13-19)26(32)31-25(18)30-24;1-14-29-12-22(33-14)23-19(15-4-5-21-16(7-15)3-2-6-28-21)8-17-9-20(18-10-26-13-27-11-18)25(32)31-24(17)30-23/h2*2-15H,1H3,(H,29,30,33);2-14H,1H3,(H,30,31,32);2-13H,1H3,(H,30,31,32)
InChIKeyQYCJDXASAJPXKX-UHFFFAOYSA-N
MW1805.03 g/mol
LogP20.84
Rot. Bonds12

About 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one

7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one (PubChem CID 160551284) has the molecular formula C105H69N19O7S3 and a molecular weight of 1805.03 g/mol. Its IUPAC name is 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
PubChem CID160551284
Molecular FormulaC105H69N19O7S3
Molecular Weight1805.03 g/mol
Exact Mass1803.48
IUPAC Name7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
SMILESCc1ccc(-c2nc3[nH]c(=O)c(-c4cncnc4)cc3cc2-c2ccc3ncccc3c2)s1.Cc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3cc2-c2ccc3ncccc3c2)o1.Cc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3cc2-c2ccc3ncccc3c2)s1.Cc1ncc(-c2nc3[nH]c(=O)c(-c4cncnc4)cc3cc2-c2ccc3ncccc3c2)s1
InChIInChI=1S/C27H18N4O3.C27H18N4O2S.C26H17N5OS.C25H16N6OS/c2*1-16-7-10-23(34-16)25-20(17-8-9-21-18(13-17)5-4-11-28-21)14-19-15-22(27(33)30-26(19)29-25)31-12-3-2-6-24(31)32;1-15-4-7-23(33-15)24-20(16-5-6-22-17(9-16)3-2-8-29-22)10-18-11-21(19-12-27-14-28-13-19)26(32)31-25(18)30-24;1-14-29-12-22(33-14)23-19(15-4-5-21-16(7-15)3-2-6-28-21)8-17-9-20(18-10-26-13-27-11-18)25(32)31-24(17)30-23/h2*2-15H,1H3,(H,29,30,33);2-14H,1H3,(H,30,31,32);2-13H,1H3,(H,30,31,32)
InChIKeyQYCJDXASAJPXKX-UHFFFAOYSA-N
XLogP20.84
TPSA356.15 Ų
H-Bond Donors4
H-Bond Acceptors25
Rotatable Bonds12
Heavy Atoms134
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001805.03
LogP ≤ 520.84
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1025

Analyze 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The IUPAC name of 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one (CID 160551284) is 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one is Cc1ccc(-c2nc3[nH]c(=O)c(-c4cncnc4)cc3cc2-c2ccc3ncccc3c2)s1.Cc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3cc2-c2ccc3ncccc3c2)o1.Cc1ccc(-c2nc3[nH]c(=O)c(-n4ccccc4=O)cc3cc2-c2ccc3ncccc3c2)s1.Cc1ncc(-c2nc3[nH]c(=O)c(-c4cncnc4)cc3cc2-c2ccc3ncccc3c2)s1.
What is the InChIKey of 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The InChIKey is QYCJDXASAJPXKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H18N4O3.C27H18N4O2S.C26H17N5OS.C25H16N6OS/c2*1-16-7-10-23(34-16)25-20(17-8-9-21-18(13-17)5-4-11-28-21)14-19-15-22(27(33)30-26(19)29-25)31-12-3-2-6-24(31)32;1-15-4-7-23(33-15)24-20(16-5-6-22-17(9-16)3-2-8-29-22)10-18-11-21(19-12-27-14-28-13-19)26(32)31-25(18)30-24;1-14-29-12-22(33-14)23-19(15-4-5-21-16(7-15)3-2-6-28-21)8-17-9-20(18-10-26-13-27-11-18)25(32)31-24(17)30-23/h2*2-15H,1H3,(H,29,30,33);2-14H,1H3,(H,30,31,32);2-13H,1H3,(H,30,31,32).
What are the key properties of 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one has a molecular weight of 1805.03 g/mol, XLogP of 20.84, 12 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-methylfuran-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(2-methyl-1,3-thiazol-5-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-(2-oxo-1-pyridinyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one;7-(5-methylthiophen-2-yl)-3-pyrimidin-5-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 160551284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).