4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide

C19H23N3O6S — CID 9492767

IUPAC4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide
SMILESCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OCC)cc2)cc1
InChIInChI=1S/C19H23N3O6S/c1-3-27-15-7-5-14(6-8-15)19(24)22-21-18(23)13-20-29(25,26)17-11-9-16(10-12-17)28-4-2/h5-12,20H,3-4,13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRUODCLZVUHBEAG-UHFFFAOYSA-N
MW421.48 g/mol
LogP1.22
Rot. Bonds9

About 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide

4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide (PubChem CID 9492767) has the molecular formula C19H23N3O6S and a molecular weight of 421.48 g/mol. Its IUPAC name is 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide
PubChem CID9492767
Molecular FormulaC19H23N3O6S
Molecular Weight421.48 g/mol
Exact Mass421.13
IUPAC Name4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide
SMILESCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OCC)cc2)cc1
InChIInChI=1S/C19H23N3O6S/c1-3-27-15-7-5-14(6-8-15)19(24)22-21-18(23)13-20-29(25,26)17-11-9-16(10-12-17)28-4-2/h5-12,20H,3-4,13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRUODCLZVUHBEAG-UHFFFAOYSA-N
XLogP1.22
TPSA122.83 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.48
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide 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-[(2R)-butan-2-yl]-4-[[(4-ethoxybenzoyl)amino]carbamoyl]benzenesulfonamide
CID 9492699
2-[(4-ethoxyphenyl)sulfonylamino]acetate
CID 4244055
N'-(4-acetylphenyl)sulfonyl-4-ethoxybenzohydrazide
CID 8617244
N-[3-[2-(4-ethoxybenzoyl)hydrazinyl]-3-oxopropyl]-3,4-difluorobenzenesulfonamide
CID 27621342
4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide
CID 8617267
4-ethoxy-N'-[2-(4-hydroxyphenyl)acetyl]benzohydrazide
CID 78821862
N'-[2-(4-ethoxyphenyl)acetyl]-4-ethylbenzohydrazide
CID 78780592
N-[2-[2-(4-ethoxyphenyl)sulfonylhydrazinyl]-2-oxoethyl]benzamide
CID 9244251
4-ethoxy-N-[4-[[(2-phenylmethoxyacetyl)amino]carbamoyl]phenyl]benzenesulfonamide
CID 55359716
4-chloro-N-[2-[(4-ethoxyphenyl)sulfonylamino]ethyl]benzamide
CID 31829485
N'-(3,4-dimethylphenyl)sulfonyl-4-ethoxybenzohydrazide
CID 8617249
N-(2,3-dimethylphenyl)-2-[(4-ethoxyphenyl)sulfonylamino]acetamide
CID 9342508

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide?
The IUPAC name of 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide (CID 9492767) is 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide is CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OCC)cc2)cc1.
What is the InChIKey of 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide?
The InChIKey is RUODCLZVUHBEAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O6S/c1-3-27-15-7-5-14(6-8-15)19(24)22-21-18(23)13-20-29(25,26)17-11-9-16(10-12-17)28-4-2/h5-12,20H,3-4,13H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide?
4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide has a molecular weight of 421.48 g/mol, XLogP of 1.22, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide is sourced from PubChem (CID 9492767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).