7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one

C22H16ClNO3 — CID 54682999

IUPAC7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one
SMILESCc1ccccc1Oc1cccc(-c2c(O)c3ccc(Cl)cc3[nH]c2=O)c1
InChIInChI=1S/C22H16ClNO3/c1-13-5-2-3-8-19(13)27-16-7-4-6-14(11-16)20-21(25)17-10-9-15(23)12-18(17)24-22(20)26/h2-12H,1H3,(H2,24,25,26)
InChIKeyBIALRNIZLCYJJP-UHFFFAOYSA-N
MW377.83 g/mol
LogP5.65
Rot. Bonds3

About 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one

7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one (PubChem CID 54682999) has the molecular formula C22H16ClNO3 and a molecular weight of 377.83 g/mol. Its IUPAC name is 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one
PubChem CID54682999
Molecular FormulaC22H16ClNO3
Molecular Weight377.83 g/mol
Exact Mass377.08
IUPAC Name7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one
SMILESCc1ccccc1Oc1cccc(-c2c(O)c3ccc(Cl)cc3[nH]c2=O)c1
InChIInChI=1S/C22H16ClNO3/c1-13-5-2-3-8-19(13)27-16-7-4-6-14(11-16)20-21(25)17-10-9-15(23)12-18(17)24-22(20)26/h2-12H,1H3,(H2,24,25,26)
InChIKeyBIALRNIZLCYJJP-UHFFFAOYSA-N
XLogP5.65
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.83
LogP ≤ 55.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-Chloro-4-hydroxy-3-(3-phenoxyphenyl)-2(1H)-quinolinone
CID 54682505
7-chloro-4-hydroxy-3-(4-phenoxyphenyl)-2(1H)-Quinolinone
CID 54679302
7-Chloro-4-hydroxy-3-[3-(4-methoxymethoxy-benzyl)-phenyl]-1H-quinolin-2-one
CID 54678940
7-chloro-4-hydroxy-3-(3-methoxyphenyl)-2(1H)-quinolone
CID 54685508
2QUINOLONE4HYDROXY7CHLORO3-p-MeO-BzPh
CID 54689452
7-chloro-5-ethyl-4-hydroxy-3-(3-methoxyphenyl)-1H-quinolin-2-one
CID 54728653
4-Amino-7-chloro-3-(3-phenoxy-phenyl)-1H-quinolin-2-one
CID 10713713
[7-Chloro-2-oxo-3-(3-phenoxy-phenyl)-1,2-dihydro-quinolin-4-yloxy]-acetic acid
CID 11796465
7-Chloro-4-hydroxy-3-[3-(thiophen-3-yloxy)-phenyl]-1H-quinolin-2-one
CID 54678923
3-(3-benzyloxyphenyl)-7-chloro-4-hydroxy-2(1H)-quinolone
CID 54684562
7-chloro-5-ethyl-4-hydroxy-3-(3-phenoxyphenyl)-1H-quinolin-2-one
CID 54702678
Fasn mrk
CID 54706679

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one?
The IUPAC name of 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one (CID 54682999) is 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one.
What is the SMILES notation for 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one?
The canonical SMILES for 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one is Cc1ccccc1Oc1cccc(-c2c(O)c3ccc(Cl)cc3[nH]c2=O)c1.
What is the InChIKey of 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one?
The InChIKey is BIALRNIZLCYJJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16ClNO3/c1-13-5-2-3-8-19(13)27-16-7-4-6-14(11-16)20-21(25)17-10-9-15(23)12-18(17)24-22(20)26/h2-12H,1H3,(H2,24,25,26).
What are the key properties of 7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one?
7-chloro-4-hydroxy-3-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one has a molecular weight of 377.83 g/mol, XLogP of 5.65, 3 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-[3-(2-methylphenoxy)phenyl]-1H-quinolin-2-one is sourced from PubChem (CID 54682999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).