7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one

C19H12ClNO3 — CID 54736899

IUPAC7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccc(-c2ccccc2)o1
InChIInChI=1S/C19H12ClNO3/c20-12-6-7-13-14(10-12)21-19(23)17(18(13)22)16-9-8-15(24-16)11-4-2-1-3-5-11/h1-10H,(H2,21,22,23)
InChIKeyJDYILZVGQUTUKJ-UHFFFAOYSA-N
MW337.76 g/mol
LogP4.81
Rot. Bonds2

About 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one

7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one (PubChem CID 54736899) has the molecular formula C19H12ClNO3 and a molecular weight of 337.76 g/mol. Its IUPAC name is 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one
PubChem CID54736899
Molecular FormulaC19H12ClNO3
Molecular Weight337.76 g/mol
Exact Mass337.05
IUPAC Name7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccc(-c2ccccc2)o1
InChIInChI=1S/C19H12ClNO3/c20-12-6-7-13-14(10-12)21-19(23)17(18(13)22)16-9-8-15(24-16)11-4-2-1-3-5-11/h1-10H,(H2,21,22,23)
InChIKeyJDYILZVGQUTUKJ-UHFFFAOYSA-N
XLogP4.81
TPSA66.23 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.76
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one?
The IUPAC name of 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one (CID 54736899) is 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one.
What is the SMILES notation for 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one?
The canonical SMILES for 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one is O=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccc(-c2ccccc2)o1.
What is the InChIKey of 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one?
The InChIKey is JDYILZVGQUTUKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClNO3/c20-12-6-7-13-14(10-12)21-19(23)17(18(13)22)16-9-8-15(24-16)11-4-2-1-3-5-11/h1-10H,(H2,21,22,23).
What are the key properties of 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one?
7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one has a molecular weight of 337.76 g/mol, XLogP of 4.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-hydroxy-3-(5-phenylfuran-2-yl)-1H-quinolin-2-one is sourced from PubChem (CID 54736899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).