N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide

C13H12N2O3S — CID 135641596

IUPACN-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
SMILESO=S(=O)(N/N=C\c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C13H12N2O3S/c16-12-8-6-11(7-9-12)10-14-15-19(17,18)13-4-2-1-3-5-13/h1-10,15-16H/b14-10-
InChIKeyWJQUOZNUGROSHH-UVTDQMKNSA-N
MW276.32 g/mol
LogP1.70
Rot. Bonds4

About N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide

N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide (PubChem CID 135641596) has the molecular formula C13H12N2O3S and a molecular weight of 276.32 g/mol. Its IUPAC name is N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide.

Molecular Properties

Compound NameN-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
PubChem CID135641596
Molecular FormulaC13H12N2O3S
Molecular Weight276.32 g/mol
Exact Mass276.06
IUPAC NameN-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
SMILESO=S(=O)(N/N=C\c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C13H12N2O3S/c16-12-8-6-11(7-9-12)10-14-15-19(17,18)13-4-2-1-3-5-13/h1-10,15-16H/b14-10-
InChIKeyWJQUOZNUGROSHH-UVTDQMKNSA-N
XLogP1.70
TPSA78.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 136661321
N-[(Z)-(4-methylphenyl)methylideneamino]benzenesulfonamide
CID 5387407
N-[(3-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 2692691
N-[[4-(dimethylamino)phenyl]methylideneamino]benzenesulfonamide
CID 872082
N-[[4-(N-phenylanilino)phenyl]methylideneamino]benzenesulfonamide
CID 3660828
N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]benzenesulfonamide
CID 139074353
N-[(4-hydroxyphenyl)methylideneamino]-3-nitrobenzenesulfonamide
CID 3881304
[4-[(Z)-(benzenesulfonylhydrazinylidene)methyl]phenyl] benzoate
CID 6164119
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]benzenesulfonamide
CID 5335146
N-[(Z)-benzylideneamino]-4-[2-[4-[[(Z)-benzylideneamino]sulfamoyl]phenyl]ethyl]benzenesulfonamide
CID 125114108
4-methyl-N-[(E)-[4-[(E)-2-phenylethenyl]phenyl]methylideneamino]benzenesulfonamide
CID 162516902
N-[[4-[(2-methylphenyl)methoxy]phenyl]methylideneamino]benzenesulfonamide
CID 1001906

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
The IUPAC name of N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide (CID 135641596) is N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide.
What is the SMILES notation for N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
The canonical SMILES for N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide is O=S(=O)(N/N=C\c1ccc(O)cc1)c1ccccc1.
What is the InChIKey of N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
The InChIKey is WJQUOZNUGROSHH-UVTDQMKNSA-N. The full InChI is InChI=1S/C13H12N2O3S/c16-12-8-6-11(7-9-12)10-14-15-19(17,18)13-4-2-1-3-5-13/h1-10,15-16H/b14-10-.
What are the key properties of N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide has a molecular weight of 276.32 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide is sourced from PubChem (CID 135641596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).