N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide

C18H11F3N4O2S — CID 58208456

IUPACN-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cccn2cc(-c3cccc(OC(F)(F)F)c3)nc12)c1cscn1
InChIInChI=1S/C18H11F3N4O2S/c19-18(20,21)27-12-4-1-3-11(7-12)14-8-25-6-2-5-13(16(25)23-14)24-17(26)15-9-28-10-22-15/h1-10H,(H,24,26)
InChIKeyKLBOHPVAXZPSEY-UHFFFAOYSA-N
MW404.37 g/mol
LogP4.61
Rot. Bonds4

About N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide

N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide (PubChem CID 58208456) has the molecular formula C18H11F3N4O2S and a molecular weight of 404.37 g/mol. Its IUPAC name is N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide
PubChem CID58208456
Molecular FormulaC18H11F3N4O2S
Molecular Weight404.37 g/mol
Exact Mass404.06
IUPAC NameN-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cccn2cc(-c3cccc(OC(F)(F)F)c3)nc12)c1cscn1
InChIInChI=1S/C18H11F3N4O2S/c19-18(20,21)27-12-4-1-3-11(7-12)14-8-25-6-2-5-13(16(25)23-14)24-17(26)15-9-28-10-22-15/h1-10H,(H,24,26)
InChIKeyKLBOHPVAXZPSEY-UHFFFAOYSA-N
XLogP4.61
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.37
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide (CID 58208456) is N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide is O=C(Nc1cccn2cc(-c3cccc(OC(F)(F)F)c3)nc12)c1cscn1.
What is the InChIKey of N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide?
The InChIKey is KLBOHPVAXZPSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11F3N4O2S/c19-18(20,21)27-12-4-1-3-11(7-12)14-8-25-6-2-5-13(16(25)23-14)24-17(26)15-9-28-10-22-15/h1-10H,(H,24,26).
What are the key properties of N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide?
N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide has a molecular weight of 404.37 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-8-yl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 58208456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).