N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine

C18H11ClFN3S — CID 118736888

IUPACN-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine
SMILESFc1ccc(Nc2ccnc3ccc(-c4cncs4)cc23)cc1Cl
InChIInChI=1S/C18H11ClFN3S/c19-14-8-12(2-3-15(14)20)23-17-5-6-22-16-4-1-11(7-13(16)17)18-9-21-10-24-18/h1-10H,(H,22,23)
InChIKeyPJJIVROEUNEVOG-UHFFFAOYSA-N
MW355.83 g/mol
LogP5.89
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine

N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine (PubChem CID 118736888) has the molecular formula C18H11ClFN3S and a molecular weight of 355.83 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine
PubChem CID118736888
Molecular FormulaC18H11ClFN3S
Molecular Weight355.83 g/mol
Exact Mass355.03
IUPAC NameN-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine
SMILESFc1ccc(Nc2ccnc3ccc(-c4cncs4)cc23)cc1Cl
InChIInChI=1S/C18H11ClFN3S/c19-14-8-12(2-3-15(14)20)23-17-5-6-22-16-4-1-11(7-13(16)17)18-9-21-10-24-18/h1-10H,(H,22,23)
InChIKeyPJJIVROEUNEVOG-UHFFFAOYSA-N
XLogP5.89
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.83
LogP ≤ 55.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine 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-N-[[5-(pyrrolidin-1-ylmethyl)-2-thienyl]methyl]quinolin-4-amine
CID 71454606
7-chloro-N-[[4-phenyl-5-(pyrrolidin-1-ylmethyl)thiazol-2-yl]methyl]quinolin-4-amine
CID 71454618
7-chloro-N-[(4-phenylthiazol-2-yl)methyl]quinolin-4-amine
CID 71458169
N-(7-chloroquinolin-4-yl)-N'-propyl-N'-(thiophen-3-ylmethyl)propane-1,3-diamine
CID 11749138
4-(3-Chloro-4-fluorophenylamino)-6-(thiazol-2-ylmethylamino)quinoline-3-carbonitrile
CID 44420096
4-(3-Chloro-4-fluoroanilino)-6-(1,3-thiazol-5-yl)quinoline-3-carboxamide
CID 44532635
N-(4-(benzo[d]thiazol-2-yl)phenyl)-7-chloroquinolin-4-amine
CID 44564862
N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)-8-(trifluoromethyl)quinazolin-4-amine
CID 118736874
N-(3-chloro-4-fluorophenyl)-8-methyl-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736876
N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736891
N-(3-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736892
N-(2-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736893

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine (CID 118736888) is N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine is Fc1ccc(Nc2ccnc3ccc(-c4cncs4)cc23)cc1Cl.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine?
The InChIKey is PJJIVROEUNEVOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClFN3S/c19-14-8-12(2-3-15(14)20)23-17-5-6-22-16-4-1-11(7-13(16)17)18-9-21-10-24-18/h1-10H,(H,22,23).
What are the key properties of N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine?
N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine has a molecular weight of 355.83 g/mol, XLogP of 5.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-6-(1,3-thiazol-5-yl)quinolin-4-amine is sourced from PubChem (CID 118736888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).