N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide

C12H11ClFN3O2S — CID 43455202

IUPACN-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide
SMILESNNc1ccccc1S(=O)(=O)Nc1cc(Cl)ccc1F
InChIInChI=1S/C12H11ClFN3O2S/c13-8-5-6-9(14)11(7-8)17-20(18,19)12-4-2-1-3-10(12)16-15/h1-7,16-17H,15H2
InChIKeyUOZWGTLNOVYUIP-UHFFFAOYSA-N
MW315.76 g/mol
LogP2.57
Rot. Bonds4

About N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide

N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide (PubChem CID 43455202) has the molecular formula C12H11ClFN3O2S and a molecular weight of 315.76 g/mol. Its IUPAC name is N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide
PubChem CID43455202
Molecular FormulaC12H11ClFN3O2S
Molecular Weight315.76 g/mol
Exact Mass315.02
IUPAC NameN-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide
SMILESNNc1ccccc1S(=O)(=O)Nc1cc(Cl)ccc1F
InChIInChI=1S/C12H11ClFN3O2S/c13-8-5-6-9(14)11(7-8)17-20(18,19)12-4-2-1-3-10(12)16-15/h1-7,16-17H,15H2
InChIKeyUOZWGTLNOVYUIP-UHFFFAOYSA-N
XLogP2.57
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 52.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide
CID 61470421
N-(5-chloro-2-fluorophenyl)-2-hydroxybenzenesulfonamide
CID 81241185
5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
CID 110759379
N-(5-chloro-2-fluorophenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300976
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 9238961
N-(5-chloro-2-fluorophenyl)-2-cyanopyridine-3-sulfonamide
CID 106595617
2-amino-N-(5-chloro-2-fluorophenyl)-4-fluorobenzenesulfonamide
CID 43438207
N-(5-chloro-2-methoxyphenyl)-2-fluorobenzenesulfonamide
CID 2696930
N-(2-bromo-6-chloro-4-fluorophenyl)-2-hydrazinylbenzenesulfonamide
CID 107613420
N-(4-fluoro-3-methoxyphenyl)-2-hydrazinylbenzenesulfonamide
CID 114840106
4-bromo-N-(5-chloro-2-fluorophenyl)-2-fluorobenzenesulfonamide
CID 116528139
N-(4-bromo-2,6-dichlorophenyl)-2-hydrazinylbenzenesulfonamide
CID 43455137

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide?
The IUPAC name of N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide (CID 43455202) is N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide.
What is the SMILES notation for N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide?
The canonical SMILES for N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide is NNc1ccccc1S(=O)(=O)Nc1cc(Cl)ccc1F.
What is the InChIKey of N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide?
The InChIKey is UOZWGTLNOVYUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClFN3O2S/c13-8-5-6-9(14)11(7-8)17-20(18,19)12-4-2-1-3-10(12)16-15/h1-7,16-17H,15H2.
What are the key properties of N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide?
N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide has a molecular weight of 315.76 g/mol, XLogP of 2.57, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-fluorophenyl)-2-hydrazinylbenzenesulfonamide is sourced from PubChem (CID 43455202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).