4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide

C14H16N2O2S — CID 786403

IUPAC4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide
SMILESCc1ccc(NNS(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C14H16N2O2S/c1-11-3-7-13(8-4-11)15-16-19(17,18)14-9-5-12(2)6-10-14/h3-10,15-16H,1-2H3
InChIKeyOSDZCCMUWCNEOP-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.61
Rot. Bonds4

About 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide

4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide (PubChem CID 786403) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide.

Molecular Properties

Compound Name4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide
PubChem CID786403
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide
SMILESCc1ccc(NNS(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C14H16N2O2S/c1-11-3-7-13(8-4-11)15-16-19(17,18)14-9-5-12(2)6-10-14/h3-10,15-16H,1-2H3
InChIKeyOSDZCCMUWCNEOP-UHFFFAOYSA-N
XLogP2.61
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.61
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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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide?
The IUPAC name of 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide (CID 786403) is 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide.
What is the SMILES notation for 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide?
The canonical SMILES for 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide is Cc1ccc(NNS(=O)(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide?
The InChIKey is OSDZCCMUWCNEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-11-3-7-13(8-4-11)15-16-19(17,18)14-9-5-12(2)6-10-14/h3-10,15-16H,1-2H3.
What are the key properties of 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide?
4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide has a molecular weight of 276.36 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N'-(4-methylphenyl)benzenesulfonohydrazide is sourced from PubChem (CID 786403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).