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

C13H11ClN2O3S — CID 136661321

IUPAC4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
SMILESO=S(=O)(N/N=C\c1ccc(O)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C13H11ClN2O3S/c14-11-3-7-13(8-4-11)20(18,19)16-15-9-10-1-5-12(17)6-2-10/h1-9,16-17H/b15-9-
InChIKeyAKVWIIXTUAFFRW-DHDCSXOGSA-N
MW310.76 g/mol
LogP2.36
Rot. Bonds4

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

4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide (PubChem CID 136661321) has the molecular formula C13H11ClN2O3S and a molecular weight of 310.76 g/mol. Its IUPAC name is 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
PubChem CID136661321
Molecular FormulaC13H11ClN2O3S
Molecular Weight310.76 g/mol
Exact Mass310.02
IUPAC Name4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
SMILESO=S(=O)(N/N=C\c1ccc(O)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C13H11ClN2O3S/c14-11-3-7-13(8-4-11)20(18,19)16-15-9-10-1-5-12(17)6-2-10/h1-9,16-17H/b15-9-
InChIKeyAKVWIIXTUAFFRW-DHDCSXOGSA-N
XLogP2.36
TPSA78.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.76
LogP ≤ 52.36
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'}

Analyze 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 135641596
4-chloro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide
CID 5186427
4-chloro-N-[(4-methylsulfanylphenyl)methylideneamino]benzenesulfonamide
CID 3594304
methyl 4-[[(4-chlorophenyl)sulfonylhydrazinylidene]methyl]benzoate
CID 5009121
4-chloro-N-(thiophen-3-ylmethylideneamino)benzenesulfonamide
CID 4167006
4-chloro-N-[(Z)-(4-propan-2-yloxyphenyl)methylideneamino]benzenesulfonamide
CID 5431289
N-[(4-chlorophenyl)methylideneamino]-4-ethoxybenzenesulfonamide
CID 2643147
4-chloro-N-[(Z)-naphthalen-2-ylmethylideneamino]benzenesulfonamide
CID 5414863
[4-[[(4-chlorophenyl)sulfonylhydrazinylidene]methyl]phenyl] 2-chlorobenzoate
CID 4232501
[4-[[(4-chlorophenyl)sulfonylhydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
CID 4132128
4-chloro-N-[(3-fluorophenyl)methylideneamino]benzenesulfonamide
CID 874024
N-(1,3-benzodioxol-5-ylmethylideneamino)-4-chlorobenzenesulfonamide
CID 696656

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
The IUPAC name of 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide (CID 136661321) is 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide.
What is the SMILES notation for 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
The canonical SMILES for 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide is O=S(=O)(N/N=C\c1ccc(O)cc1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
The InChIKey is AKVWIIXTUAFFRW-DHDCSXOGSA-N. The full InChI is InChI=1S/C13H11ClN2O3S/c14-11-3-7-13(8-4-11)20(18,19)16-15-9-10-1-5-12(17)6-2-10/h1-9,16-17H/b15-9-.
What are the key properties of 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide?
4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide has a molecular weight of 310.76 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide is sourced from PubChem (CID 136661321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).