N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide

C16H18N2O4S — CID 7974595

IUPACN'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide
SMILESCCOc1ccc(S(=O)(=O)NNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C16H18N2O4S/c1-2-22-14-8-10-15(11-9-14)23(20,21)18-17-16(19)12-13-6-4-3-5-7-13/h3-11,18H,2,12H2,1H3,(H,17,19)
InChIKeyARBJOXOICCNGHN-UHFFFAOYSA-N
MW334.40 g/mol
LogP1.64
Rot. Bonds7

About N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide

N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide (PubChem CID 7974595) has the molecular formula C16H18N2O4S and a molecular weight of 334.40 g/mol. Its IUPAC name is N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide.

Molecular Properties

Compound NameN'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide
PubChem CID7974595
Molecular FormulaC16H18N2O4S
Molecular Weight334.40 g/mol
Exact Mass334.10
IUPAC NameN'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide
SMILESCCOc1ccc(S(=O)(=O)NNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C16H18N2O4S/c1-2-22-14-8-10-15(11-9-14)23(20,21)18-17-16(19)12-13-6-4-3-5-7-13/h3-11,18H,2,12H2,1H3,(H,17,19)
InChIKeyARBJOXOICCNGHN-UHFFFAOYSA-N
XLogP1.64
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-bromophenyl)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
CID 7478651
N'-(4-ethoxyphenyl)sulfonyl-2-(2-methoxyphenyl)acetohydrazide
CID 7974521
N'-(4-ethoxyphenyl)sulfonyl-2-phenylsulfanylacetohydrazide
CID 7478638
1-N',6-N'-bis[(4-ethoxyphenyl)sulfonyl]hexanedihydrazide
CID 3116496
N-[2-[2-(4-ethoxyphenyl)sulfonylhydrazinyl]-2-oxoethyl]benzamide
CID 9244251
N'-(benzenesulfonyl)-2-(4-phenylmethoxyphenoxy)acetohydrazide
CID 26982271
2-(1,3-dioxoisoindol-2-yl)-N'-(4-ethoxyphenyl)sulfonylacetohydrazide
CID 9244319
N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide
CID 917648
N-[[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamothioyl]-2-phenylacetamide
CID 3308515
N'-(4-acetylphenyl)sulfonyl-4-ethoxybenzohydrazide
CID 8617244
N'-[1-(4-ethoxyphenyl)ethenyl]-2-phenylacetohydrazide
CID 3420448
N-(4-chlorophenyl)sulfonyl-2-(4-ethoxyphenyl)acetamide
CID 166208857

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide?
The IUPAC name of N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide (CID 7974595) is N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide.
What is the SMILES notation for N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide?
The canonical SMILES for N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide is CCOc1ccc(S(=O)(=O)NNC(=O)Cc2ccccc2)cc1.
What is the InChIKey of N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide?
The InChIKey is ARBJOXOICCNGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4S/c1-2-22-14-8-10-15(11-9-14)23(20,21)18-17-16(19)12-13-6-4-3-5-7-13/h3-11,18H,2,12H2,1H3,(H,17,19).
What are the key properties of N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide?
N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide has a molecular weight of 334.40 g/mol, XLogP of 1.64, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide is sourced from PubChem (CID 7974595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).