N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide

C13H10Cl2N2O2S — CID 5387404

IUPACN-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide
SMILESO=S(=O)(N/N=C\c1ccc(Cl)cc1Cl)c1ccccc1
InChIInChI=1S/C13H10Cl2N2O2S/c14-11-7-6-10(13(15)8-11)9-16-17-20(18,19)12-4-2-1-3-5-12/h1-9,17H/b16-9-
InChIKeyGXHCURFFVDKZPK-SXGWCWSVSA-N
MW329.21 g/mol
LogP3.31
Rot. Bonds4

About N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide

N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide (PubChem CID 5387404) has the molecular formula C13H10Cl2N2O2S and a molecular weight of 329.21 g/mol. Its IUPAC name is N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide.

Molecular Properties

Compound NameN-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide
PubChem CID5387404
Molecular FormulaC13H10Cl2N2O2S
Molecular Weight329.21 g/mol
Exact Mass327.98
IUPAC NameN-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide
SMILESO=S(=O)(N/N=C\c1ccc(Cl)cc1Cl)c1ccccc1
InChIInChI=1S/C13H10Cl2N2O2S/c14-11-7-6-10(13(15)8-11)9-16-17-20(18,19)12-4-2-1-3-5-12/h1-9,17H/b16-9-
InChIKeyGXHCURFFVDKZPK-SXGWCWSVSA-N
XLogP3.31
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.21
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(2,4-dichlorophenyl)methylideneamino]-4-methylbenzenesulfonamide
CID 668213
N-[(2-chlorophenyl)methylideneamino]benzenesulfonamide
CID 1474680
N-[(E)-(2,4-dichlorophenyl)methylideneamino]-4-ethoxybenzenesulfonamide
CID 6908616
N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide
CID 867204
N-[(2-chloro-4,5-dimethoxyphenyl)methylideneamino]benzenesulfonamide
CID 1001980
N-[(E)-(2-fluorophenyl)methylideneamino]benzenesulfonamide
CID 6894293
N-[(E)-(2-chloro-5-methoxyphenyl)methylideneamino]benzenesulfonamide
CID 25169959
N-[(2,4-dichlorophenyl)methylideneamino]-2,5-dimethylbenzenesulfonamide
CID 4017599
N-[(Z)-(2-chloro-5-nitrophenyl)methylideneamino]benzenesulfonamide
CID 5414600
N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]benzenesulfonamide
CID 6897306
N-[(4-chloro-2-fluorophenyl)methylideneamino]-4-methylbenzenesulfonamide
CID 171035196
N-[(2,3,4-trimethylphenyl)methylideneamino]benzenesulfonamide
CID 881745

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide?
The IUPAC name of N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide (CID 5387404) is N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide.
What is the SMILES notation for N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide?
The canonical SMILES for N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide is O=S(=O)(N/N=C\c1ccc(Cl)cc1Cl)c1ccccc1.
What is the InChIKey of N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide?
The InChIKey is GXHCURFFVDKZPK-SXGWCWSVSA-N. The full InChI is InChI=1S/C13H10Cl2N2O2S/c14-11-7-6-10(13(15)8-11)9-16-17-20(18,19)12-4-2-1-3-5-12/h1-9,17H/b16-9-.
What are the key properties of N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide?
N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide has a molecular weight of 329.21 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide is sourced from PubChem (CID 5387404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).