2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide

C17H19ClN2O5S — CID 9244388

IUPAC2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
SMILESCCOc1ccc(S(=O)(=O)NNC(=O)COc2cc(C)ccc2Cl)cc1
InChIInChI=1S/C17H19ClN2O5S/c1-3-24-13-5-7-14(8-6-13)26(22,23)20-19-17(21)11-25-16-10-12(2)4-9-15(16)18/h4-10,20H,3,11H2,1-2H3,(H,19,21)
InChIKeyOYCOAGJDHSVHPL-UHFFFAOYSA-N
MW398.87 g/mol
LogP2.44
Rot. Bonds8

About 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide

2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide (PubChem CID 9244388) has the molecular formula C17H19ClN2O5S and a molecular weight of 398.87 g/mol. Its IUPAC name is 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide.

Molecular Properties

Compound Name2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
PubChem CID9244388
Molecular FormulaC17H19ClN2O5S
Molecular Weight398.87 g/mol
Exact Mass398.07
IUPAC Name2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
SMILESCCOc1ccc(S(=O)(=O)NNC(=O)COc2cc(C)ccc2Cl)cc1
InChIInChI=1S/C17H19ClN2O5S/c1-3-24-13-5-7-14(8-6-13)26(22,23)20-19-17(21)11-25-16-10-12(2)4-9-15(16)18/h4-10,20H,3,11H2,1-2H3,(H,19,21)
InChIKeyOYCOAGJDHSVHPL-UHFFFAOYSA-N
XLogP2.44
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.87
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide 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'-(4-methylphenyl)sulfonyl-2-(2,4,5-trichlorophenoxy)acetohydrazide
CID 165343411
2-(4-ethylphenoxy)-N'-(4-methylphenyl)sulfonylacetohydrazide
CID 3374893
1-N',6-N'-bis[(4-ethoxyphenyl)sulfonyl]hexanedihydrazide
CID 3116496
2-(2-chloro-5-methylphenoxy)-N-(4-ethoxy-2-nitrophenyl)acetamide
CID 46786988
N-(2-chloro-4-methylphenyl)-4-ethoxybenzenesulfonamide
CID 7514268
N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide
CID 7974595
2-(4-chlorophenoxy)-N'-(4-propylphenyl)sulfonylacetohydrazide
CID 8615109
2-(4-ethoxyphenoxy)-N'-(4-methylphenyl)sulfonylpropanehydrazide
CID 55353301
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(4-ethoxyphenyl)acetohydrazide
CID 27568812
2-(4-bromophenyl)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
CID 7478651
2-(2-chloro-5-methylphenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 7778322
N'-(4-ethoxyphenyl)sulfonyl-2-(2-methoxyphenyl)acetohydrazide
CID 7974521

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide?
The IUPAC name of 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide (CID 9244388) is 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide.
What is the SMILES notation for 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide?
The canonical SMILES for 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide is CCOc1ccc(S(=O)(=O)NNC(=O)COc2cc(C)ccc2Cl)cc1.
What is the InChIKey of 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide?
The InChIKey is OYCOAGJDHSVHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O5S/c1-3-24-13-5-7-14(8-6-13)26(22,23)20-19-17(21)11-25-16-10-12(2)4-9-15(16)18/h4-10,20H,3,11H2,1-2H3,(H,19,21).
What are the key properties of 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide?
2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide has a molecular weight of 398.87 g/mol, XLogP of 2.44, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-5-methylphenoxy)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide is sourced from PubChem (CID 9244388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).