phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone

C16H11NOS — CID 20535189

IUPACphenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone
SMILESO=C(c1ccccc1)c1ccccc1-c1nccs1
InChIInChI=1S/C16H11NOS/c18-15(12-6-2-1-3-7-12)13-8-4-5-9-14(13)16-17-10-11-19-16/h1-11H
InChIKeyYACOJUUXOPCYAR-UHFFFAOYSA-N
MW265.34 g/mol
LogP4.04
Rot. Bonds3

About phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone

phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone (PubChem CID 20535189) has the molecular formula C16H11NOS and a molecular weight of 265.34 g/mol. Its IUPAC name is phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone.

Molecular Properties

Compound Namephenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone
PubChem CID20535189
Molecular FormulaC16H11NOS
Molecular Weight265.34 g/mol
Exact Mass265.06
IUPAC Namephenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone
SMILESO=C(c1ccccc1)c1ccccc1-c1nccs1
InChIInChI=1S/C16H11NOS/c18-15(12-6-2-1-3-7-12)13-8-4-5-9-14(13)16-17-10-11-19-16/h1-11H
InChIKeyYACOJUUXOPCYAR-UHFFFAOYSA-N
XLogP4.04
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone?
The IUPAC name of phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone (CID 20535189) is phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone.
What is the SMILES notation for phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone?
The canonical SMILES for phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone is O=C(c1ccccc1)c1ccccc1-c1nccs1.
What is the InChIKey of phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone?
The InChIKey is YACOJUUXOPCYAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NOS/c18-15(12-6-2-1-3-7-12)13-8-4-5-9-14(13)16-17-10-11-19-16/h1-11H.
What are the key properties of phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone?
phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone has a molecular weight of 265.34 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-(1,3-thiazol-2-yl)phenyl]methanone is sourced from PubChem (CID 20535189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).