N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide

C18H15FN2O5S — CID 17468607

IUPACN'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide
SMILESO=C(NNS(=O)(=O)c1ccc(F)cc1)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C18H15FN2O5S/c19-13-6-9-16(10-7-13)27(23,24)21-20-18(22)17-11-8-15(26-17)12-25-14-4-2-1-3-5-14/h1-11,21H,12H2,(H,20,22)
InChIKeyRZGPUZAPWSCNNC-UHFFFAOYSA-N
MW390.39 g/mol
LogP2.62
Rot. Bonds7

About N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide

N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide (PubChem CID 17468607) has the molecular formula C18H15FN2O5S and a molecular weight of 390.39 g/mol. Its IUPAC name is N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide
PubChem CID17468607
Molecular FormulaC18H15FN2O5S
Molecular Weight390.39 g/mol
Exact Mass390.07
IUPAC NameN'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide
SMILESO=C(NNS(=O)(=O)c1ccc(F)cc1)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C18H15FN2O5S/c19-13-6-9-16(10-7-13)27(23,24)21-20-18(22)17-11-8-15(26-17)12-25-14-4-2-1-3-5-14/h1-11,21H,12H2,(H,20,22)
InChIKeyRZGPUZAPWSCNNC-UHFFFAOYSA-N
XLogP2.62
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.39
LogP ≤ 52.62
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

5-(Phenoxymethyl)furan-2-carbohydrazide
CID 2125524
5-((4-Fluorophenoxy)methyl)-2-furancarboxylic acid hydrazide
CID 717235
N'-(benzenesulfonyl)furan-2-carbohydrazide
CID 247396
N'-(4-fluorophenyl)sulfonyl-7-methoxy-1-benzofuran-2-carbohydrazide
CID 10109352
N'-(3-fluorophenyl)sulfonyl-7-methoxy-1-benzofuran-2-carbohydrazide
CID 59980822
N'-(furan-2-carbonyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 9476640
N'-[(4-fluorophenyl)sulfonyl]-2-furohydrazide
CID 750786
N'-(3,4-difluorophenyl)sulfonylfuran-2-carbohydrazide
CID 2551628
N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 4795196
5-[(2,4-Difluorophenoxy)methyl]furan-2-carbohydrazide
CID 7020951
5-[(2,3,5,6-Tetrafluorophenoxy)methyl]furan-2-carbohydrazide
CID 7020953
N'-[2-(2-fluorophenoxy)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 7601194

Frequently Asked Questions

What is the IUPAC name of N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide?
The IUPAC name of N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide (CID 17468607) is N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide?
The canonical SMILES for N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide is O=C(NNS(=O)(=O)c1ccc(F)cc1)c1ccc(COc2ccccc2)o1.
What is the InChIKey of N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide?
The InChIKey is RZGPUZAPWSCNNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O5S/c19-13-6-9-16(10-7-13)27(23,24)21-20-18(22)17-11-8-15(26-17)12-25-14-4-2-1-3-5-14/h1-11,21H,12H2,(H,20,22).
What are the key properties of N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide?
N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide has a molecular weight of 390.39 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-fluorophenyl)sulfonyl-5-(phenoxymethyl)furan-2-carbohydrazide is sourced from PubChem (CID 17468607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).