N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide

C13H14N2O3S — CID 102581250

IUPACN'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide
SMILESCc1ccc(S(=O)(=O)NNc2ccc(O)cc2)cc1
InChIInChI=1S/C13H14N2O3S/c1-10-2-8-13(9-3-10)19(17,18)15-14-11-4-6-12(16)7-5-11/h2-9,14-16H,1H3
InChIKeyHHXHFPOJGQZSMJ-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.01
Rot. Bonds4

About N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide

N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide (PubChem CID 102581250) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide.

Molecular Properties

Compound NameN'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide
PubChem CID102581250
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC NameN'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide
SMILESCc1ccc(S(=O)(=O)NNc2ccc(O)cc2)cc1
InChIInChI=1S/C13H14N2O3S/c1-10-2-8-13(9-3-10)19(17,18)15-14-11-4-6-12(16)7-5-11/h2-9,14-16H,1H3
InChIKeyHHXHFPOJGQZSMJ-UHFFFAOYSA-N
XLogP2.01
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(4-hydroxyphenyl)-3-(4-methylphenyl)sulfonylurea
CID 5268819
methyl N-[(4-methylphenyl)sulfonylamino]carbamate
CID 795389
1-N',4-N'-bis-(4-methylphenyl)sulfonylbutanedihydrazide
CID 5153632
4-[methylidene-(4-methylphenyl)-oxo-λ6-sulfanyl]phenol
CID 145421044
4-methyl-N'-(2-methylphenyl)benzenesulfonohydrazide
CID 102581241
N-[4-[(4-bromoanilino)sulfamoyl]phenyl]acetamide
CID 118706841
N-[4-[(4-sulfamoylanilino)sulfamoyl]phenyl]acetamide
CID 3595344
N-[2-(4-hydroxyphenyl)ethyl]-4-methylbenzenesulfonamide
CID 10424386
bis(4-(4-methylphenyl)sulfonylphenol);molecular hydrogen;hydrochloride
CID 160552688
N-(4-methylphenyl)-4-[4-[(4-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 4994558
1-methyl-4-(sulfinatosulfamoyl)benzene
CID 57311516
4-(trifluoromethyl)-N'-[4-(trifluoromethyl)phenyl]benzenesulfonohydrazide
CID 20705865

Frequently Asked Questions

What is the IUPAC name of N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide?
The IUPAC name of N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide (CID 102581250) is N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide.
What is the SMILES notation for N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide?
The canonical SMILES for N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide is Cc1ccc(S(=O)(=O)NNc2ccc(O)cc2)cc1.
What is the InChIKey of N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide?
The InChIKey is HHXHFPOJGQZSMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-10-2-8-13(9-3-10)19(17,18)15-14-11-4-6-12(16)7-5-11/h2-9,14-16H,1H3.
What are the key properties of N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide?
N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide has a molecular weight of 278.33 g/mol, XLogP of 2.01, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-hydroxyphenyl)-4-methylbenzenesulfonohydrazide is sourced from PubChem (CID 102581250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).