N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide

C18H15NO3S — CID 894213

IUPACN-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(O)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H15NO3S/c20-17-10-8-16(9-11-17)19-23(21,22)18-12-6-15(7-13-18)14-4-2-1-3-5-14/h1-13,19-20H
InChIKeySZOPCHOOHZIDKC-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.86
Rot. Bonds4

About N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide

N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide (PubChem CID 894213) has the molecular formula C18H15NO3S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide
PubChem CID894213
Molecular FormulaC18H15NO3S
Molecular Weight325.39 g/mol
Exact Mass325.08
IUPAC NameN-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(O)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H15NO3S/c20-17-10-8-16(9-11-17)19-23(21,22)18-12-6-15(7-13-18)14-4-2-1-3-5-14/h1-13,19-20H
InChIKeySZOPCHOOHZIDKC-UHFFFAOYSA-N
XLogP3.86
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(4-Hydroxyphenyl)benzenesulfonamide
CID 79622
N-(4-hydroxyphenyl)-2,4,6-trimethylbenzenesulfonamide
CID 754032
Benzenesulfonamide, N-(5-hydroxy-1-naphthalenyl)-4-methyl-
CID 104703
N-(4-hydroxynaphthalen-1-yl)-2,4-dimethylbenzenesulfonamide
CID 746288
N-(4-hydroxyphenyl)-2,5-dimethylbenzenesulfonamide
CID 846970
4-tert-butyl-N-(4-hydroxynaphthalen-1-yl)benzenesulfonamide
CID 1106000
4-(2,4-difluorophenyl)-N-[2-hydroxy-5-(hydroxymethyl)phenyl]benzenesulfonamide
CID 25098359
N-(2-hydroxyphenyl)-4-biphenylsulfonamide
CID 893823
N-(4-hydroxy-3,5-dimethylphenyl)benzenesulfonamide
CID 674493
N-(4-hydroxy-2,6-dimethylphenyl)benzenesulfonamide
CID 747919
N-(4-hydroxyphenyl)-2,4,5-trimethylbenzenesulfonamide
CID 697331
4-ethyl-N-(4-hydroxy-1-naphthyl)benzenesulfonamide
CID 726569

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide?
The IUPAC name of N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide (CID 894213) is N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide?
The canonical SMILES for N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide is O=S(=O)(Nc1ccc(O)cc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide?
The InChIKey is SZOPCHOOHZIDKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3S/c20-17-10-8-16(9-11-17)19-23(21,22)18-12-6-15(7-13-18)14-4-2-1-3-5-14/h1-13,19-20H.
What are the key properties of N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide?
N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide has a molecular weight of 325.39 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-4-phenylbenzenesulfonamide is sourced from PubChem (CID 894213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).