4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one

C18H13N3OS — CID 22638519

IUPAC4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one
SMILESCc1c(-c2csc(-c3ccncc3)n2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C18H13N3OS/c1-11-13-4-2-3-5-14(13)20-17(22)16(11)15-10-23-18(21-15)12-6-8-19-9-7-12/h2-10H,1H3,(H,20,22)
InChIKeyHEAJXQJJYJLZEZ-UHFFFAOYSA-N
MW319.39 g/mol
LogP4.02
Rot. Bonds2

About 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one

4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one (PubChem CID 22638519) has the molecular formula C18H13N3OS and a molecular weight of 319.39 g/mol. Its IUPAC name is 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one.

Molecular Properties

Compound Name4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one
PubChem CID22638519
Molecular FormulaC18H13N3OS
Molecular Weight319.39 g/mol
Exact Mass319.08
IUPAC Name4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one
SMILESCc1c(-c2csc(-c3ccncc3)n2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C18H13N3OS/c1-11-13-4-2-3-5-14(13)20-17(22)16(11)15-10-23-18(21-15)12-6-8-19-9-7-12/h2-10H,1H3,(H,20,22)
InChIKeyHEAJXQJJYJLZEZ-UHFFFAOYSA-N
XLogP4.02
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-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

N4-benzyl-2-(3-pyridyl)-1,3-thiazole-4-carboxamide
CID 2824333
3-[2-(Pyridin-4-yl)-1,3-thiazol-4-yl]-7-(trifluoromethyl)-1,2-dihydroquinolin-2-one
CID 10126343
4-Amino-6-(4-methylpiperazin-1-yl)-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10127012
3-[2-(4-Amino-phenyl)-thiazol-4-yl]-1H-quinolin-2-one
CID 10149743
4-Amino-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10171950
4-Phenyl-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10193998
7-[(4-Methylpiperazin-1-yl)carbonyl]-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10194805
3-{2-[(Pyridine-2-sulfonyl)methyl]-1,3-thiazol-4-yl}-1,2-dihydroquinolin-2-one
CID 10215918
3-[2-(Pyridin-3-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10236551
4-Amino-6-chloro-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10237032
4-Amino-6-(piperidin-1-yl)-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10237718
N,N-diethyl-2-oxo-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinoline-5-carboxamide
CID 10237742

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one?
The IUPAC name of 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one (CID 22638519) is 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one.
What is the SMILES notation for 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one?
The canonical SMILES for 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one is Cc1c(-c2csc(-c3ccncc3)n2)c(=O)[nH]c2ccccc12.
What is the InChIKey of 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one?
The InChIKey is HEAJXQJJYJLZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3OS/c1-11-13-4-2-3-5-14(13)20-17(22)16(11)15-10-23-18(21-15)12-6-8-19-9-7-12/h2-10H,1H3,(H,20,22).
What are the key properties of 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one?
4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one has a molecular weight of 319.39 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one is sourced from PubChem (CID 22638519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).