N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide

C15H14F2N2O3S — CID 8504905

IUPACN'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide
SMILESCc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)cc2F)c(C)c1
InChIInChI=1S/C15H14F2N2O3S/c1-9-3-5-12(10(2)7-9)15(20)18-19-23(21,22)14-6-4-11(16)8-13(14)17/h3-8,19H,1-2H3,(H,18,20)
InChIKeyVYIFEYNRWRJIBL-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.20
Rot. Bonds4

About N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide

N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide (PubChem CID 8504905) has the molecular formula C15H14F2N2O3S and a molecular weight of 340.35 g/mol. Its IUPAC name is N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide.

Molecular Properties

Compound NameN'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide
PubChem CID8504905
Molecular FormulaC15H14F2N2O3S
Molecular Weight340.35 g/mol
Exact Mass340.07
IUPAC NameN'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide
SMILESCc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)cc2F)c(C)c1
InChIInChI=1S/C15H14F2N2O3S/c1-9-3-5-12(10(2)7-9)15(20)18-19-23(21,22)14-6-4-11(16)8-13(14)17/h3-8,19H,1-2H3,(H,18,20)
InChIKeyVYIFEYNRWRJIBL-UHFFFAOYSA-N
XLogP2.20
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-fluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide
CID 8504906
N'-(2,5-difluorobenzoyl)-2,4-dimethylbenzohydrazide
CID 24644754
methyl N-[(2,4-difluorophenyl)sulfonylamino]carbamate
CID 47104395
N'-(2-bromo-4-fluorobenzoyl)-2,4-dimethylbenzohydrazide
CID 9276694
N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide
CID 60532960
N'-(4-bromo-3-methylphenyl)sulfonyl-2,4-dimethylbenzohydrazide
CID 8504967
N'-(2,4-difluorophenyl)sulfonyl-3,4,5-trimethoxybenzohydrazide
CID 8523643
N'-(5-chlorothiophen-2-yl)sulfonyl-2,4-dimethylbenzohydrazide
CID 8504948
4-bromo-N'-(2,4-difluorophenyl)sulfonyl-1-methylpyrrole-2-carbohydrazide
CID 17420156
N-(2,4-dimethylphenyl)-3-[[(4-fluoro-2-methylphenyl)sulfonylamino]carbamoyl]benzenesulfonamide
CID 30666490
4-fluoro-N-(2-fluoro-5-methylphenyl)-2-methylbenzamide
CID 112702327
3-ethoxy-N'-(2-fluoro-4-methylphenyl)sulfonyl-5-methylbenzohydrazide
CID 155511214

Frequently Asked Questions

What is the IUPAC name of N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide?
The IUPAC name of N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide (CID 8504905) is N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide.
What is the SMILES notation for N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide?
The canonical SMILES for N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide is Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)cc2F)c(C)c1.
What is the InChIKey of N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide?
The InChIKey is VYIFEYNRWRJIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O3S/c1-9-3-5-12(10(2)7-9)15(20)18-19-23(21,22)14-6-4-11(16)8-13(14)17/h3-8,19H,1-2H3,(H,18,20).
What are the key properties of N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide?
N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide has a molecular weight of 340.35 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide is sourced from PubChem (CID 8504905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).