N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide

C15H11ClFN3O4S — CID 8614364

IUPACN'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide
SMILESN#Cc1ccc(OCC(=O)NNS(=O)(=O)c2ccc(Cl)cc2F)cc1
InChIInChI=1S/C15H11ClFN3O4S/c16-11-3-6-14(13(17)7-11)25(22,23)20-19-15(21)9-24-12-4-1-10(8-18)2-5-12/h1-7,20H,9H2,(H,19,21)
InChIKeyZPVCCMFVPSNZNL-UHFFFAOYSA-N
MW383.79 g/mol
LogP1.74
Rot. Bonds6

About N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide

N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide (PubChem CID 8614364) has the molecular formula C15H11ClFN3O4S and a molecular weight of 383.79 g/mol. Its IUPAC name is N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide.

Molecular Properties

Compound NameN'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide
PubChem CID8614364
Molecular FormulaC15H11ClFN3O4S
Molecular Weight383.79 g/mol
Exact Mass383.01
IUPAC NameN'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide
SMILESN#Cc1ccc(OCC(=O)NNS(=O)(=O)c2ccc(Cl)cc2F)cc1
InChIInChI=1S/C15H11ClFN3O4S/c16-11-3-6-14(13(17)7-11)25(22,23)20-19-15(21)9-24-12-4-1-10(8-18)2-5-12/h1-7,20H,9H2,(H,19,21)
InChIKeyZPVCCMFVPSNZNL-UHFFFAOYSA-N
XLogP1.74
TPSA108.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.79
LogP ≤ 51.74
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

2-(4-cyanophenoxy)-N'-(2,4-difluorophenyl)sulfonylacetohydrazide
CID 8614297
2-(4-cyanophenoxy)-N'-(2,5-dichlorophenyl)sulfonylacetohydrazide
CID 8614315
N'-[2-(4-cyanophenoxy)acetyl]-2-(2,4-dichlorophenyl)acetohydrazide
CID 7978491
N'-(4-bromophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide
CID 2420734
[2-(4-chloro-2-fluoroanilino)-2-oxoethyl] 2-(4-cyanophenoxy)acetate
CID 9141284
N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-ethoxyphenoxy)propanehydrazide
CID 55353346
N-(2-amino-5-chlorophenyl)-2-(4-cyanophenoxy)acetamide
CID 29050645
N'-(benzenesulfonyl)-2-(4-chlorophenoxy)acetohydrazide
CID 905489
2-[4-(4-cyanophenyl)phenoxy]-N-(2,4-dichlorophenyl)acetamide
CID 1034300
N-(5-chloro-2-methoxyphenyl)-2-(4-cyanophenoxy)acetamide
CID 7503472
2-(4-cyanophenoxy)-N'-(2,3-dihydro-1H-inden-5-ylsulfonyl)acetohydrazide
CID 8614390
N'-(3-cyanophenyl)sulfonyl-2-(2,4-dichlorophenoxy)acetohydrazide
CID 8500499

Frequently Asked Questions

What is the IUPAC name of N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide?
The IUPAC name of N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide (CID 8614364) is N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide.
What is the SMILES notation for N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide?
The canonical SMILES for N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide is N#Cc1ccc(OCC(=O)NNS(=O)(=O)c2ccc(Cl)cc2F)cc1.
What is the InChIKey of N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide?
The InChIKey is ZPVCCMFVPSNZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFN3O4S/c16-11-3-6-14(13(17)7-11)25(22,23)20-19-15(21)9-24-12-4-1-10(8-18)2-5-12/h1-7,20H,9H2,(H,19,21).
What are the key properties of N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide?
N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide has a molecular weight of 383.79 g/mol, XLogP of 1.74, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chloro-2-fluorophenyl)sulfonyl-2-(4-cyanophenoxy)acetohydrazide is sourced from PubChem (CID 8614364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).