N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide

C15H16N2O5S — CID 917648

IUPACN'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide
SMILESCOc1ccc(OCC(=O)NNS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C15H16N2O5S/c1-21-12-7-9-13(10-8-12)22-11-15(18)16-17-23(19,20)14-5-3-2-4-6-14/h2-10,17H,11H2,1H3,(H,16,18)
InChIKeyUSOISWOKAPHGLH-UHFFFAOYSA-N
MW336.37 g/mol
LogP1.08
Rot. Bonds7

About N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide

N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide (PubChem CID 917648) has the molecular formula C15H16N2O5S and a molecular weight of 336.37 g/mol. Its IUPAC name is N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide.

Molecular Properties

Compound NameN'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide
PubChem CID917648
Molecular FormulaC15H16N2O5S
Molecular Weight336.37 g/mol
Exact Mass336.08
IUPAC NameN'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide
SMILESCOc1ccc(OCC(=O)NNS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C15H16N2O5S/c1-21-12-7-9-13(10-8-12)22-11-15(18)16-17-23(19,20)14-5-3-2-4-6-14/h2-10,17H,11H2,1H3,(H,16,18)
InChIKeyUSOISWOKAPHGLH-UHFFFAOYSA-N
XLogP1.08
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-(benzenesulfonyl)-2-(4-chlorophenoxy)acetohydrazide
CID 905489
N'-(benzenesulfonyl)-2-(4-phenylmethoxyphenoxy)acetohydrazide
CID 26982271
N'-(benzenesulfonyl)-4-methoxybenzohydrazide
CID 795528
2-(2-fluorophenoxy)-N'-(4-methoxyphenyl)sulfonylacetohydrazide
CID 8614556
2-(4-ethylphenoxy)-N'-naphthalen-2-ylsulfonylacetohydrazide
CID 8614803
N'-(4-ethoxyphenyl)sulfonyl-2-phenylacetohydrazide
CID 7974595
2-(4-nitrophenoxy)-N'-(4-nitrophenyl)sulfonylacetohydrazide
CID 19166679
2-(4-ethylphenoxy)-N'-(4-methylphenyl)sulfonylacetohydrazide
CID 3374893
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 28552297
N'-(4-ethoxyphenyl)sulfonyl-2-(2-methoxyphenyl)acetohydrazide
CID 7974521
N'-(4-tert-butylphenyl)sulfonyl-2-(2-methoxyphenoxy)acetohydrazide
CID 8506530
N'-(benzenesulfonyl)-2-(1-bromonaphthalen-2-yl)oxyacetohydrazide
CID 3387456

Frequently Asked Questions

What is the IUPAC name of N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide?
The IUPAC name of N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide (CID 917648) is N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide.
What is the SMILES notation for N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide?
The canonical SMILES for N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide is COc1ccc(OCC(=O)NNS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide?
The InChIKey is USOISWOKAPHGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O5S/c1-21-12-7-9-13(10-8-12)22-11-15(18)16-17-23(19,20)14-5-3-2-4-6-14/h2-10,17H,11H2,1H3,(H,16,18).
What are the key properties of N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide?
N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide has a molecular weight of 336.37 g/mol, XLogP of 1.08, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(benzenesulfonyl)-2-(4-methoxyphenoxy)acetohydrazide is sourced from PubChem (CID 917648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).