N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide

C14H13FN2O4S — CID 60532960

IUPACN'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide
SMILESCc1ccc(F)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1
InChIInChI=1S/C14H13FN2O4S/c1-9-6-7-11(15)13(8-9)22(20,21)17-16-14(19)10-4-2-3-5-12(10)18/h2-8,17-18H,1H3,(H,16,19)
InChIKeyGAIQBAMFLNTIDI-UHFFFAOYSA-N
MW324.33 g/mol
LogP1.46
Rot. Bonds4

About N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide

N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide (PubChem CID 60532960) has the molecular formula C14H13FN2O4S and a molecular weight of 324.33 g/mol. Its IUPAC name is N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide.

Molecular Properties

Compound NameN'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide
PubChem CID60532960
Molecular FormulaC14H13FN2O4S
Molecular Weight324.33 g/mol
Exact Mass324.06
IUPAC NameN'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide
SMILESCc1ccc(F)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1
InChIInChI=1S/C14H13FN2O4S/c1-9-6-7-11(15)13(8-9)22(20,21)17-16-14(19)10-4-2-3-5-12(10)18/h2-8,17-18H,1H3,(H,16,19)
InChIKeyGAIQBAMFLNTIDI-UHFFFAOYSA-N
XLogP1.46
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.33
LogP ≤ 51.46
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

2-hydroxy-N'-(4-methylphenyl)sulfonylbenzohydrazide
CID 766765
N'-(2,4-difluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide
CID 8504905
2-fluoro-N'-(2,3,4,5,6-pentamethylphenyl)sulfonylbenzohydrazide
CID 8523929
2-fluoro-5-(4-fluorophenyl)-N'-(2-fluorophenyl)sulfonylbenzohydrazide
CID 155926750
N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide
CID 8523599
N'-(benzenesulfonyl)-2,5-dimethylbenzohydrazide
CID 54112488
2,5-dimethyl-N'-(2,3,4-trifluorophenyl)sulfonylfuran-3-carbohydrazide
CID 29424945
N'-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-2-fluorobenzohydrazide
CID 27658205
N'-(2,5-dichlorothiophen-3-yl)sulfonyl-2-fluorobenzohydrazide
CID 29099080
N'-(4-fluorophenyl)sulfonyl-2,4-dimethylbenzohydrazide
CID 8504906
N'-(2-chloro-4-methylphenyl)sulfonylbenzohydrazide
CID 32673196
2-[(2-fluoro-5-methylphenyl)sulfonylamino]-5-methylbenzoic acid
CID 51114826

Frequently Asked Questions

What is the IUPAC name of N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide?
The IUPAC name of N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide (CID 60532960) is N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide.
What is the SMILES notation for N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide?
The canonical SMILES for N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide is Cc1ccc(F)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1.
What is the InChIKey of N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide?
The InChIKey is GAIQBAMFLNTIDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O4S/c1-9-6-7-11(15)13(8-9)22(20,21)17-16-14(19)10-4-2-3-5-12(10)18/h2-8,17-18H,1H3,(H,16,19).
What are the key properties of N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide?
N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide has a molecular weight of 324.33 g/mol, XLogP of 1.46, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluoro-5-methylphenyl)sulfonyl-2-hydroxybenzohydrazide is sourced from PubChem (CID 60532960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).