N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide

C14H15FN2O4S2 — CID 8523599

IUPACN'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide
SMILESCc1ccc(C)c(S(=O)(=O)NNS(=O)(=O)c2ccccc2F)c1
InChIInChI=1S/C14H15FN2O4S2/c1-10-7-8-11(2)14(9-10)23(20,21)17-16-22(18,19)13-6-4-3-5-12(13)15/h3-9,16-17H,1-2H3
InChIKeyVUTDCBIYNIOKKE-UHFFFAOYSA-N
MW358.42 g/mol
LogP1.61
Rot. Bonds5

About N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide

N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide (PubChem CID 8523599) has the molecular formula C14H15FN2O4S2 and a molecular weight of 358.42 g/mol. Its IUPAC name is N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide.

Molecular Properties

Compound NameN'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide
PubChem CID8523599
Molecular FormulaC14H15FN2O4S2
Molecular Weight358.42 g/mol
Exact Mass358.05
IUPAC NameN'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide
SMILESCc1ccc(C)c(S(=O)(=O)NNS(=O)(=O)c2ccccc2F)c1
InChIInChI=1S/C14H15FN2O4S2/c1-10-7-8-11(2)14(9-10)23(20,21)17-16-22(18,19)13-6-4-3-5-12(13)15/h3-9,16-17H,1-2H3
InChIKeyVUTDCBIYNIOKKE-UHFFFAOYSA-N
XLogP1.61
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2,5-dichlorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide
CID 8523597
5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide
CID 8519696
2-fluoro-1-(2-fluorophenyl)sulfonyl-4-methylbenzene
CID 162721199
2,5-dimethyl-N-(2,3,4,5,6-pentafluorophenyl)benzenesulfonamide
CID 22774539
N-(2,6-dimethylphenyl)-2,5-dimethylbenzenesulfonamide
CID 8504690
(2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 984226
N-(fluoren-9-ylideneamino)-2,5-dimethylbenzenesulfonamide
CID 4297375
N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide
CID 60532960
N-(5-amino-2-methylphenyl)-2-fluorobenzenesulfonamide
CID 16773575
1,3-bis[(2,5-dimethylphenyl)sulfonyl]urea
CID 134090359
N-(3-chloro-4-fluorophenyl)-2,5-dimethylbenzenesulfonamide
CID 793232
2,5-dimethyl-N-[2-(trifluoromethyl)phenyl]benzenesulfonamide
CID 22774165

Frequently Asked Questions

What is the IUPAC name of N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide?
The IUPAC name of N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide (CID 8523599) is N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide.
What is the SMILES notation for N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide?
The canonical SMILES for N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide is Cc1ccc(C)c(S(=O)(=O)NNS(=O)(=O)c2ccccc2F)c1.
What is the InChIKey of N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide?
The InChIKey is VUTDCBIYNIOKKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O4S2/c1-10-7-8-11(2)14(9-10)23(20,21)17-16-22(18,19)13-6-4-3-5-12(13)15/h3-9,16-17H,1-2H3.
What are the key properties of N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide?
N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide has a molecular weight of 358.42 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide is sourced from PubChem (CID 8523599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).