4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

C23H16N2O2S — CID 2318924

IUPAC4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccc2)cs1)c1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C23H16N2O2S/c26-21(17-9-5-2-6-10-17)18-11-13-19(14-12-18)22(27)25-23-24-20(15-28-23)16-7-3-1-4-8-16/h1-15H,(H,24,25,27)
InChIKeyARPJLXJZGILMIN-UHFFFAOYSA-N
MW384.46 g/mol
LogP5.29
Rot. Bonds5

About 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (PubChem CID 2318924) has the molecular formula C23H16N2O2S and a molecular weight of 384.46 g/mol. Its IUPAC name is 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
PubChem CID2318924
Molecular FormulaC23H16N2O2S
Molecular Weight384.46 g/mol
Exact Mass384.09
IUPAC Name4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccc2)cs1)c1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C23H16N2O2S/c26-21(17-9-5-2-6-10-17)18-11-13-19(14-12-18)22(27)25-23-24-20(15-28-23)16-7-3-1-4-8-16/h1-15H,(H,24,25,27)
InChIKeyARPJLXJZGILMIN-UHFFFAOYSA-N
XLogP5.29
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.46
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (CID 2318924) is 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is O=C(Nc1nc(-c2ccccc2)cs1)c1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is ARPJLXJZGILMIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O2S/c26-21(17-9-5-2-6-10-17)18-11-13-19(14-12-18)22(27)25-23-24-20(15-28-23)16-7-3-1-4-8-16/h1-15H,(H,24,25,27).
What are the key properties of 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 384.46 g/mol, XLogP of 5.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzoyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2318924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).