3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one

C19H14N2O2S2 — CID 142273169

IUPAC3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one
SMILESCS(=O)c1ccc(-c2csc(-c3cc4ccccc4[nH]c3=O)n2)cc1
InChIInChI=1S/C19H14N2O2S2/c1-25(23)14-8-6-12(7-9-14)17-11-24-19(21-17)15-10-13-4-2-3-5-16(13)20-18(15)22/h2-11H,1H3,(H,20,22)
InChIKeyLZGMRMZXKXLZLK-UHFFFAOYSA-N
MW366.47 g/mol
LogP4.06
Rot. Bonds3

About 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one

3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one (PubChem CID 142273169) has the molecular formula C19H14N2O2S2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one
PubChem CID142273169
Molecular FormulaC19H14N2O2S2
Molecular Weight366.47 g/mol
Exact Mass366.05
IUPAC Name3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one
SMILESCS(=O)c1ccc(-c2csc(-c3cc4ccccc4[nH]c3=O)n2)cc1
InChIInChI=1S/C19H14N2O2S2/c1-25(23)14-8-6-12(7-9-14)17-11-24-19(21-17)15-10-13-4-2-3-5-16(13)20-18(15)22/h2-11H,1H3,(H,20,22)
InChIKeyLZGMRMZXKXLZLK-UHFFFAOYSA-N
XLogP4.06
TPSA62.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-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

3-[2-(2-methyl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-1H-quinolin-2-one
CID 22638613
3-[2-(4-hydroxyphenyl)-1,3-thiazol-4-yl]-1H-quinolin-2-one
CID 135528630
3-[2-(6-oxo-1H-pyridin-3-yl)-1,3-thiazol-4-yl]-1H-quinolin-2-one
CID 135443299
3-[2-(5-thiophen-2-ylthiophen-2-yl)-1,3-thiazol-4-yl]-1H-quinolin-2-one
CID 22638521
3-(2,6-diphenyl-4-pyridinyl)-1H-quinolin-2-one
CID 25231803
3-[2-[2-(2-methoxyethoxy)-4-pyridinyl]-1,3-thiazol-4-yl]-1H-quinolin-2-one
CID 22638610
3-[2-(benzenesulfonylmethyl)-1,3-thiazol-4-yl]-1H-quinolin-2-one
CID 10287269
3-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]-1H-quinolin-2-one
CID 10287537
3-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-1H-quinolin-2-one
CID 155962167
methyl 2-oxo-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinoline-7-carboxylate
CID 69453571
3-[2-(benzenesulfinylmethyl)-1,3-thiazol-4-yl]-7-methoxy-1H-quinolin-2-one
CID 142273118
3-(3-chlorophenyl)-1H-quinolin-2-one
CID 152763617

Frequently Asked Questions

What is the IUPAC name of 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one?
The IUPAC name of 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one (CID 142273169) is 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one.
What is the SMILES notation for 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one?
The canonical SMILES for 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one is CS(=O)c1ccc(-c2csc(-c3cc4ccccc4[nH]c3=O)n2)cc1.
What is the InChIKey of 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one?
The InChIKey is LZGMRMZXKXLZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2S2/c1-25(23)14-8-6-12(7-9-14)17-11-24-19(21-17)15-10-13-4-2-3-5-16(13)20-18(15)22/h2-11H,1H3,(H,20,22).
What are the key properties of 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one?
3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one has a molecular weight of 366.47 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(4-methylsulfinylphenyl)-1,3-thiazol-2-yl]-1H-quinolin-2-one is sourced from PubChem (CID 142273169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).