N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide

C16H12F2N2O2S — CID 67058031

IUPACN,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide
SMILESO=S(Cc1ncco1)N(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C16H12F2N2O2S/c17-12-1-5-14(6-2-12)20(15-7-3-13(18)4-8-15)23(21)11-16-19-9-10-22-16/h1-10H,11H2
InChIKeySOWLRZJRSIJSPL-UHFFFAOYSA-N
MW334.35 g/mol
LogP3.95
Rot. Bonds5

About N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide

N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide (PubChem CID 67058031) has the molecular formula C16H12F2N2O2S and a molecular weight of 334.35 g/mol. Its IUPAC name is N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide.

Molecular Properties

Compound NameN,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide
PubChem CID67058031
Molecular FormulaC16H12F2N2O2S
Molecular Weight334.35 g/mol
Exact Mass334.06
IUPAC NameN,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide
SMILESO=S(Cc1ncco1)N(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C16H12F2N2O2S/c17-12-1-5-14(6-2-12)20(15-7-3-13(18)4-8-15)23(21)11-16-19-9-10-22-16/h1-10H,11H2
InChIKeySOWLRZJRSIJSPL-UHFFFAOYSA-N
XLogP3.95
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.35
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide 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,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide?
The IUPAC name of N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide (CID 67058031) is N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide.
What is the SMILES notation for N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide?
The canonical SMILES for N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide is O=S(Cc1ncco1)N(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide?
The InChIKey is SOWLRZJRSIJSPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2N2O2S/c17-12-1-5-14(6-2-12)20(15-7-3-13(18)4-8-15)23(21)11-16-19-9-10-22-16/h1-10H,11H2.
What are the key properties of N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide?
N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide has a molecular weight of 334.35 g/mol, XLogP of 3.95, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-fluorophenyl)-1-(1,3-oxazol-2-yl)methanesulfinamide is sourced from PubChem (CID 67058031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).