3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide

C13H9Cl3N2O3S — CID 8616581

IUPAC3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide
SMILESO=C(NNS(=O)(=O)c1cc(Cl)ccc1Cl)c1cccc(Cl)c1
InChIInChI=1S/C13H9Cl3N2O3S/c14-9-3-1-2-8(6-9)13(19)17-18-22(20,21)12-7-10(15)4-5-11(12)16/h1-7,18H,(H,17,19)
InChIKeyRYOYGTBNRWWMFK-UHFFFAOYSA-N
MW379.65 g/mol
LogP3.27
Rot. Bonds4

About 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide

3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide (PubChem CID 8616581) has the molecular formula C13H9Cl3N2O3S and a molecular weight of 379.65 g/mol. Its IUPAC name is 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide.

Molecular Properties

Compound Name3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide
PubChem CID8616581
Molecular FormulaC13H9Cl3N2O3S
Molecular Weight379.65 g/mol
Exact Mass377.94
IUPAC Name3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide
SMILESO=C(NNS(=O)(=O)c1cc(Cl)ccc1Cl)c1cccc(Cl)c1
InChIInChI=1S/C13H9Cl3N2O3S/c14-9-3-1-2-8(6-9)13(19)17-18-22(20,21)12-7-10(15)4-5-11(12)16/h1-7,18H,(H,17,19)
InChIKeyRYOYGTBNRWWMFK-UHFFFAOYSA-N
XLogP3.27
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.65
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide 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

N'-(2,5-dichlorophenyl)sulfonylacetohydrazide
CID 8500705
N'-(2,5-dichlorophenyl)sulfonylfuran-2-carbohydrazide
CID 8616857
4-chloro-3-[[(4-hydroxybenzoyl)amino]sulfamoyl]benzoic acid
CID 100820484
3-chloro-N'-(3,4-dimethoxyphenyl)sulfonylbenzohydrazide
CID 8616663
N'-(4-chlorophenyl)sulfonyl-3-methylbenzohydrazide
CID 732337
N'-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-3-chlorobenzohydrazide
CID 8616616
3-chloro-N'-[4-(trifluoromethoxy)phenyl]sulfonylbenzohydrazide
CID 8616640
N-(4-carbamoylphenyl)-3-[(2,5-dichlorophenyl)sulfonylamino]benzamide
CID 24640884
3-bromo-N'-(2-fluorophenyl)sulfonylbenzohydrazide
CID 155532167
N-cyclopropyl-2-[2-(2,5-dichlorophenyl)sulfonylhydrazinyl]-2-oxoacetamide
CID 8841216
N'-tert-butyl-3-chlorobenzohydrazide
CID 15617772
4-hydroxy-N'-(2,4,5-trichlorophenyl)sulfonylbenzohydrazide
CID 100820121

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide?
The IUPAC name of 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide (CID 8616581) is 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide.
What is the SMILES notation for 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide?
The canonical SMILES for 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide is O=C(NNS(=O)(=O)c1cc(Cl)ccc1Cl)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide?
The InChIKey is RYOYGTBNRWWMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl3N2O3S/c14-9-3-1-2-8(6-9)13(19)17-18-22(20,21)12-7-10(15)4-5-11(12)16/h1-7,18H,(H,17,19).
What are the key properties of 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide?
3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide has a molecular weight of 379.65 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N'-(2,5-dichlorophenyl)sulfonylbenzohydrazide is sourced from PubChem (CID 8616581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).