1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone

C14H10F2N2O2S — CID 115791892

IUPAC1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
SMILESO=C(Cc1cn2ccsc2n1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C14H10F2N2O2S/c15-13(16)20-11-3-1-9(2-4-11)12(19)7-10-8-18-5-6-21-14(18)17-10/h1-6,8,13H,7H2
InChIKeyRVNZXSGGOYOQEM-UHFFFAOYSA-N
MW308.31 g/mol
LogP3.42
Rot. Bonds5

About 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone

1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone (PubChem CID 115791892) has the molecular formula C14H10F2N2O2S and a molecular weight of 308.31 g/mol. Its IUPAC name is 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone.

Molecular Properties

Compound Name1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
PubChem CID115791892
Molecular FormulaC14H10F2N2O2S
Molecular Weight308.31 g/mol
Exact Mass308.04
IUPAC Name1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
SMILESO=C(Cc1cn2ccsc2n1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C14H10F2N2O2S/c15-13(16)20-11-3-1-9(2-4-11)12(19)7-10-8-18-5-6-21-14(18)17-10/h1-6,8,13H,7H2
InChIKeyRVNZXSGGOYOQEM-UHFFFAOYSA-N
XLogP3.42
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.31
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone 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 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone?
The IUPAC name of 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone (CID 115791892) is 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone.
What is the SMILES notation for 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone?
The canonical SMILES for 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone is O=C(Cc1cn2ccsc2n1)c1ccc(OC(F)F)cc1.
What is the InChIKey of 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone?
The InChIKey is RVNZXSGGOYOQEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N2O2S/c15-13(16)20-11-3-1-9(2-4-11)12(19)7-10-8-18-5-6-21-14(18)17-10/h1-6,8,13H,7H2.
What are the key properties of 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone?
1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone has a molecular weight of 308.31 g/mol, XLogP of 3.42, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(difluoromethoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone is sourced from PubChem (CID 115791892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).