4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide

C19H14ClNO4S — CID 40569558

IUPAC4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1ccc(S(=O)(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H14ClNO4S/c20-14-7-11-16(12-8-14)26(24,25)15-9-5-13(6-10-15)19(23)21-17-3-1-2-4-18(17)22/h1-12,22H,(H,21,23)
InChIKeyZDGLJEQRHSKMFZ-UHFFFAOYSA-N
MW387.84 g/mol
LogP4.13
Rot. Bonds4

About 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide

4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide (PubChem CID 40569558) has the molecular formula C19H14ClNO4S and a molecular weight of 387.84 g/mol. Its IUPAC name is 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide
PubChem CID40569558
Molecular FormulaC19H14ClNO4S
Molecular Weight387.84 g/mol
Exact Mass387.03
IUPAC Name4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1ccc(S(=O)(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H14ClNO4S/c20-14-7-11-16(12-8-14)26(24,25)15-9-5-13(6-10-15)19(23)21-17-3-1-2-4-18(17)22/h1-12,22H,(H,21,23)
InChIKeyZDGLJEQRHSKMFZ-UHFFFAOYSA-N
XLogP4.13
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.84
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

Analyze 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide?
The IUPAC name of 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide (CID 40569558) is 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide.
What is the SMILES notation for 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide?
The canonical SMILES for 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide is O=C(Nc1ccccc1O)c1ccc(S(=O)(=O)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide?
The InChIKey is ZDGLJEQRHSKMFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClNO4S/c20-14-7-11-16(12-8-14)26(24,25)15-9-5-13(6-10-15)19(23)21-17-3-1-2-4-18(17)22/h1-12,22H,(H,21,23).
What are the key properties of 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide?
4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide has a molecular weight of 387.84 g/mol, XLogP of 4.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)sulfonyl-N-(2-hydroxyphenyl)benzamide is sourced from PubChem (CID 40569558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).