4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide

C18H22N2O4S — CID 8617267

IUPAC4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C18H22N2O4S/c1-4-24-16-9-5-15(6-10-16)18(21)19-20-25(22,23)17-11-7-14(8-12-17)13(2)3/h5-13,20H,4H2,1-3H3,(H,19,21)
InChIKeyRUUKDLFLXIXGFH-UHFFFAOYSA-N
MW362.45 g/mol
LogP2.83
Rot. Bonds7

About 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide

4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide (PubChem CID 8617267) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide.

Molecular Properties

Compound Name4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide
PubChem CID8617267
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC Name4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C18H22N2O4S/c1-4-24-16-9-5-15(6-10-16)18(21)19-20-25(22,23)17-11-7-14(8-12-17)13(2)3/h5-13,20H,4H2,1-3H3,(H,19,21)
InChIKeyRUUKDLFLXIXGFH-UHFFFAOYSA-N
XLogP2.83
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-ethoxy-N'-(4-propan-2-ylphenyl)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'-(4-acetylphenyl)sulfonyl-4-ethoxybenzohydrazide
CID 8617244
N'-(3,5-dichlorophenyl)sulfonyl-4-ethoxybenzohydrazide
CID 8617286
N-[(2R)-butan-2-yl]-4-[[(4-ethoxybenzoyl)amino]carbamoyl]benzenesulfonamide
CID 9492699
N'-(3,4-dimethylphenyl)sulfonyl-4-ethoxybenzohydrazide
CID 8617249
4-ethoxy-N-(4-propan-2-ylphenyl)benzamide
CID 673574
N'-(4-ethoxyphenyl)sulfonyl-3-(2-methylpropoxy)benzohydrazide
CID 8624005
3,4,5-trimethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide
CID 8523659
4-ethoxy-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzenesulfonamide
CID 9492767
1-N',6-N'-bis[(4-ethoxyphenyl)sulfonyl]hexanedihydrazide
CID 3116496
N-[2-[2-(4-ethoxyphenyl)sulfonylhydrazinyl]-2-oxoethyl]benzamide
CID 9244251
N-[(2S)-1-[2-(4-ethoxybenzoyl)hydrazinyl]-1-oxopropan-2-yl]-4-fluorobenzenesulfonamide
CID 9327605
4-[[(4-propan-2-yloxybenzoyl)amino]sulfamoyl]benzoic acid
CID 45477229

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide?
The IUPAC name of 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide (CID 8617267) is 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide.
What is the SMILES notation for 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide?
The canonical SMILES for 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide is CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(C)C)cc2)cc1.
What is the InChIKey of 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide?
The InChIKey is RUUKDLFLXIXGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-4-24-16-9-5-15(6-10-16)18(21)19-20-25(22,23)17-11-7-14(8-12-17)13(2)3/h5-13,20H,4H2,1-3H3,(H,19,21).
What are the key properties of 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide?
4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide has a molecular weight of 362.45 g/mol, XLogP of 2.83, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide is sourced from PubChem (CID 8617267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).