2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide

C15H11FN2O2S2 — CID 167476036

IUPAC2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1cnc(-c2ccc(F)cc2)s1
InChIInChI=1S/C15H11FN2O2S2/c16-12-8-6-11(7-9-12)15-17-10-14(21-15)22(19,20)18-13-4-2-1-3-5-13/h1-10,18H
InChIKeyFUCGQTKWOGQLKG-UHFFFAOYSA-N
MW334.40 g/mol
LogP3.75
Rot. Bonds4

About 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide

2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide (PubChem CID 167476036) has the molecular formula C15H11FN2O2S2 and a molecular weight of 334.40 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide
PubChem CID167476036
Molecular FormulaC15H11FN2O2S2
Molecular Weight334.40 g/mol
Exact Mass334.02
IUPAC Name2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)c1cnc(-c2ccc(F)cc2)s1
InChIInChI=1S/C15H11FN2O2S2/c16-12-8-6-11(7-9-12)15-17-10-14(21-15)22(19,20)18-13-4-2-1-3-5-13/h1-10,18H
InChIKeyFUCGQTKWOGQLKG-UHFFFAOYSA-N
XLogP3.75
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide (CID 167476036) is 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide is O=S(=O)(Nc1ccccc1)c1cnc(-c2ccc(F)cc2)s1.
What is the InChIKey of 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide?
The InChIKey is FUCGQTKWOGQLKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2S2/c16-12-8-6-11(7-9-12)15-17-10-14(21-15)22(19,20)18-13-4-2-1-3-5-13/h1-10,18H.
What are the key properties of 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide?
2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide has a molecular weight of 334.40 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-phenyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 167476036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).