2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole

C15H9Cl2NS — CID 71463263

IUPAC2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole
SMILESClc1cccc(-c2nc(-c3ccccc3)cs2)c1Cl
InChIInChI=1S/C15H9Cl2NS/c16-12-8-4-7-11(14(12)17)15-18-13(9-19-15)10-5-2-1-3-6-10/h1-9H
InChIKeyUWGPIKUUHZLUQA-UHFFFAOYSA-N
MW306.22 g/mol
LogP5.78
Rot. Bonds2

About 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole

2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole (PubChem CID 71463263) has the molecular formula C15H9Cl2NS and a molecular weight of 306.22 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole
PubChem CID71463263
Molecular FormulaC15H9Cl2NS
Molecular Weight306.22 g/mol
Exact Mass304.98
IUPAC Name2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole
SMILESClc1cccc(-c2nc(-c3ccccc3)cs2)c1Cl
InChIInChI=1S/C15H9Cl2NS/c16-12-8-4-7-11(14(12)17)15-18-13(9-19-15)10-5-2-1-3-6-10/h1-9H
InChIKeyUWGPIKUUHZLUQA-UHFFFAOYSA-N
XLogP5.78
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.22
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole?
The IUPAC name of 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole (CID 71463263) is 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole?
The canonical SMILES for 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole is Clc1cccc(-c2nc(-c3ccccc3)cs2)c1Cl.
What is the InChIKey of 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole?
The InChIKey is UWGPIKUUHZLUQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2NS/c16-12-8-4-7-11(14(12)17)15-18-13(9-19-15)10-5-2-1-3-6-10/h1-9H.
What are the key properties of 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole?
2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole has a molecular weight of 306.22 g/mol, XLogP of 5.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-4-phenyl-1,3-thiazole is sourced from PubChem (CID 71463263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).