N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide

C18H15N3O3S — CID 135298789

IUPACN'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide
SMILESO=C(NNS(=O)(=O)c1ccccc1)c1cccc(-c2cccnc2)c1
InChIInChI=1S/C18H15N3O3S/c22-18(20-21-25(23,24)17-9-2-1-3-10-17)15-7-4-6-14(12-15)16-8-5-11-19-13-16/h1-13,21H,(H,20,22)
InChIKeyRGUQKCWTLXRSTL-UHFFFAOYSA-N
MW353.40 g/mol
LogP2.37
Rot. Bonds5

About N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide

N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide (PubChem CID 135298789) has the molecular formula C18H15N3O3S and a molecular weight of 353.40 g/mol. Its IUPAC name is N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide.

Molecular Properties

Compound NameN'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide
PubChem CID135298789
Molecular FormulaC18H15N3O3S
Molecular Weight353.40 g/mol
Exact Mass353.08
IUPAC NameN'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide
SMILESO=C(NNS(=O)(=O)c1ccccc1)c1cccc(-c2cccnc2)c1
InChIInChI=1S/C18H15N3O3S/c22-18(20-21-25(23,24)17-9-2-1-3-10-17)15-7-4-6-14(12-15)16-8-5-11-19-13-16/h1-13,21H,(H,20,22)
InChIKeyRGUQKCWTLXRSTL-UHFFFAOYSA-N
XLogP2.37
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.40
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

WM-1119
CID 133080719
N-hydroxy-4-({[(pyridin-3-yl)methyl][(2,3,4,5-tetrafluorophenyl)sulfonyl]amino}methyl)benzamide
CID 155144635
4-Acetyl-N-pyridin-3-ylmethyl-benzenesulfonamide
CID 746813
2-Amino-5-(pyridin-4-yl)-3-(4-sulfamoylphenyl)benzamide
CID 16047968
2-fluoro-3-methyl-N'-(phenylsulfonyl)-5-(pyridin-2-yl)benzohydrazide
CID 134581398
N'-isonicotinoylbenzenesulfonohydrazide
CID 468603
N'-(3-phenylpropanoyl)pyridine-4-carbohydrazide
CID 846328
N,N-dimethyl-4-[(E)-3-pyridin-3-ylprop-2-enoyl]benzenesulfonamide
CID 16304783
3-[(3R,4R)-1-(1-Benzenesulfonyl-1H-pyrrol-2-ylmethyl)-3,4-dimethyl-piperidin-4-yl]-benzamide
CID 44358923
N'-(benzenesulfonyl)-3-pyridin-2-ylbenzohydrazide
CID 124132171
N'-(2-fluorophenyl)sulfonyl-3-pyridin-2-ylbenzohydrazide
CID 124132172
N-[[4-(benzenesulfonamidomethyl)phenyl]methyl]pyridine-4-carboxamide
CID 130431478

Frequently Asked Questions

What is the IUPAC name of N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide?
The IUPAC name of N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide (CID 135298789) is N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide.
What is the SMILES notation for N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide?
The canonical SMILES for N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide is O=C(NNS(=O)(=O)c1ccccc1)c1cccc(-c2cccnc2)c1.
What is the InChIKey of N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide?
The InChIKey is RGUQKCWTLXRSTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O3S/c22-18(20-21-25(23,24)17-9-2-1-3-10-17)15-7-4-6-14(12-15)16-8-5-11-19-13-16/h1-13,21H,(H,20,22).
What are the key properties of N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide?
N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide has a molecular weight of 353.40 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(benzenesulfonyl)-3-pyridin-3-ylbenzohydrazide is sourced from PubChem (CID 135298789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).