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

C16H12N2O3S2 — CID 154862316

IUPAC4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide
SMILESO=C(NS(=O)(=O)c1nccs1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H12N2O3S2/c19-15(18-23(20,21)16-17-10-11-22-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H,(H,18,19)
InChIKeyZFXWSBGGBRXGNH-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.93
Rot. Bonds4

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

4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide (PubChem CID 154862316) has the molecular formula C16H12N2O3S2 and a molecular weight of 344.42 g/mol. Its IUPAC name is 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide.

Molecular Properties

Compound Name4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide
PubChem CID154862316
Molecular FormulaC16H12N2O3S2
Molecular Weight344.42 g/mol
Exact Mass344.03
IUPAC Name4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide
SMILESO=C(NS(=O)(=O)c1nccs1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H12N2O3S2/c19-15(18-23(20,21)16-17-10-11-22-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H,(H,18,19)
InChIKeyZFXWSBGGBRXGNH-UHFFFAOYSA-N
XLogP2.93
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361308
4-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]benzamide
CID 49357165
N-ethylsulfonyl-4-phenylbenzamide
CID 140633529
N-[(3-phenylphenyl)methyl]-4-(1,3-thiazol-2-ylsulfamoyl)benzamide
CID 87488273
4-phenoxy-N-(4-phenylphenyl)sulfonylbenzamide
CID 53473228
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
CID 90597412
4-amino-N-pyridin-2-ylsulfonylbenzamide
CID 153322012
4-amino-3-phenyl-N-(1,3-thiazol-2-yl)benzamide
CID 86046995
2-[[4-(1,3-thiazol-2-ylsulfamoyl)benzoyl]amino]acetic acid
CID 146122970
bis[4-(1,3-thiazol-2-yl)phenyl]methanone
CID 146425122
N-(benzenesulfonyl)-4-chlorobenzamide
CID 2355220

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide?
The IUPAC name of 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide (CID 154862316) is 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide.
What is the SMILES notation for 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide?
The canonical SMILES for 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide is O=C(NS(=O)(=O)c1nccs1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide?
The InChIKey is ZFXWSBGGBRXGNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O3S2/c19-15(18-23(20,21)16-17-10-11-22-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H,(H,18,19).
What are the key properties of 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide?
4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide has a molecular weight of 344.42 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(1,3-thiazol-2-ylsulfonyl)benzamide is sourced from PubChem (CID 154862316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).