2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide

C14H14N2O4S — CID 766765

IUPAC2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide
SMILESCc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1
InChIInChI=1S/C14H14N2O4S/c1-10-6-8-11(9-7-10)21(19,20)16-15-14(18)12-4-2-3-5-13(12)17/h2-9,16-17H,1H3,(H,15,18)
InChIKeyVJFIOTMTSRVFGJ-UHFFFAOYSA-N
MW306.34 g/mol
LogP1.32
Rot. Bonds4

About 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide

2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide (PubChem CID 766765) has the molecular formula C14H14N2O4S and a molecular weight of 306.34 g/mol. Its IUPAC name is 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide.

Molecular Properties

Compound Name2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide
PubChem CID766765
Molecular FormulaC14H14N2O4S
Molecular Weight306.34 g/mol
Exact Mass306.07
IUPAC Name2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide
SMILESCc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1
InChIInChI=1S/C14H14N2O4S/c1-10-6-8-11(9-7-10)21(19,20)16-15-14(18)12-4-2-3-5-13(12)17/h2-9,16-17H,1H3,(H,15,18)
InChIKeyVJFIOTMTSRVFGJ-UHFFFAOYSA-N
XLogP1.32
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-N-[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]benzenesulfonamide
CID 4711775
2-hydroxy-N'-(4-propylphenyl)sulfonylbenzohydrazide
CID 8511154
2-hydroxy-N'-[4-(2-methylpropyl)phenyl]sulfonylbenzohydrazide
CID 39324521
N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide
CID 60532960
N'-(benzenesulfonyl)-2,5-dimethylbenzohydrazide
CID 54112488
2-(2,6-diethylanilino)-N'-(4-methylphenyl)sulfonylbenzohydrazide
CID 3510733
N'-(4-methylphenyl)sulfonylpyridine-2-carbohydrazide
CID 26951444
N-[4-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]benzamide
CID 3293465
4-tert-butyl-N'-(4-methylphenyl)sulfonylbenzohydrazide
CID 923515
N'-(4-chlorophenyl)sulfonyl-4-methylbenzohydrazide
CID 932051
3-[[(2-hydroxybenzoyl)amino]carbamoyl]-N,4-dimethylbenzenesulfonamide
CID 35804401
N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-hydroxybenzohydrazide
CID 8511209

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide?
The IUPAC name of 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide (CID 766765) is 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide.
What is the SMILES notation for 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide?
The canonical SMILES for 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide is Cc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1.
What is the InChIKey of 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide?
The InChIKey is VJFIOTMTSRVFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4S/c1-10-6-8-11(9-7-10)21(19,20)16-15-14(18)12-4-2-3-5-13(12)17/h2-9,16-17H,1H3,(H,15,18).
What are the key properties of 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide?
2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide has a molecular weight of 306.34 g/mol, XLogP of 1.32, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide is sourced from PubChem (CID 766765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).