4-methyl-N',N'-diphenylbenzenesulfonohydrazide

C19H18N2O2S — CID 711063

IUPAC4-methyl-N',N'-diphenylbenzenesulfonohydrazide
SMILESCc1ccc(S(=O)(=O)NN(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H18N2O2S/c1-16-12-14-19(15-13-16)24(22,23)20-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,20H,1H3
InChIKeyKXAFXMXACBYLEC-UHFFFAOYSA-N
MW338.43 g/mol
LogP4.03
Rot. Bonds5

About 4-methyl-N',N'-diphenylbenzenesulfonohydrazide

4-methyl-N',N'-diphenylbenzenesulfonohydrazide (PubChem CID 711063) has the molecular formula C19H18N2O2S and a molecular weight of 338.43 g/mol. Its IUPAC name is 4-methyl-N',N'-diphenylbenzenesulfonohydrazide.

Molecular Properties

Compound Name4-methyl-N',N'-diphenylbenzenesulfonohydrazide
PubChem CID711063
Molecular FormulaC19H18N2O2S
Molecular Weight338.43 g/mol
Exact Mass338.11
IUPAC Name4-methyl-N',N'-diphenylbenzenesulfonohydrazide
SMILESCc1ccc(S(=O)(=O)NN(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H18N2O2S/c1-16-12-14-19(15-13-16)24(22,23)20-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,20H,1H3
InChIKeyKXAFXMXACBYLEC-UHFFFAOYSA-N
XLogP4.03
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethyl 4-[(N-phenylanilino)sulfamoyl]benzoate
CID 2405740
4-methyl-N-[3-[N-methyl-4-(N-methylanilino)anilino]phenyl]benzenesulfonamide
CID 54015900
N-fluoro-4-methyl-N-phenylbenzenesulfonamide
CID 146522187
N-(benzenesulfonyl)-N'-(4-methylphenyl)sulfonylpropanediamide
CID 135051885
4-methyl-N-oxidobenzenesulfonamide
CID 141387140
N-[(4-methylphenyl)sulfonylmethyl]benzenesulfonamide
CID 23452751
4-methyl-N'-(2-methylphenyl)benzenesulfonohydrazide
CID 102581241
4-methyl-N-[(1R,2R)-2-(N-methylanilino)cyclopentyl]benzenesulfonamide
CID 11405210
4-methylbenzenesulfonohydrazide
CID 15303
N-(2-amino-1-phenylethyl)-4-methylbenzenesulfonamide
CID 18003405
N-(chloromethyl)-4-methyl-N-phenylbenzenesulfonamide
CID 69007007
lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide
CID 173095463

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N',N'-diphenylbenzenesulfonohydrazide?
The IUPAC name of 4-methyl-N',N'-diphenylbenzenesulfonohydrazide (CID 711063) is 4-methyl-N',N'-diphenylbenzenesulfonohydrazide.
What is the SMILES notation for 4-methyl-N',N'-diphenylbenzenesulfonohydrazide?
The canonical SMILES for 4-methyl-N',N'-diphenylbenzenesulfonohydrazide is Cc1ccc(S(=O)(=O)NN(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-methyl-N',N'-diphenylbenzenesulfonohydrazide?
The InChIKey is KXAFXMXACBYLEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2S/c1-16-12-14-19(15-13-16)24(22,23)20-21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,20H,1H3.
What are the key properties of 4-methyl-N',N'-diphenylbenzenesulfonohydrazide?
4-methyl-N',N'-diphenylbenzenesulfonohydrazide has a molecular weight of 338.43 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N',N'-diphenylbenzenesulfonohydrazide is sourced from PubChem (CID 711063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).