N'-benzylsulfonylfuran-2-carbohydrazide

C12H12N2O4S — CID 8515985

IUPACN'-benzylsulfonylfuran-2-carbohydrazide
SMILESO=C(NNS(=O)(=O)Cc1ccccc1)c1ccco1
InChIInChI=1S/C12H12N2O4S/c15-12(11-7-4-8-18-11)13-14-19(16,17)9-10-5-2-1-3-6-10/h1-8,14H,9H2,(H,13,15)
InChIKeyRHGONPAXNNYYAG-UHFFFAOYSA-N
MW280.31 g/mol
LogP1.04
Rot. Bonds5

About N'-benzylsulfonylfuran-2-carbohydrazide

N'-benzylsulfonylfuran-2-carbohydrazide (PubChem CID 8515985) has the molecular formula C12H12N2O4S and a molecular weight of 280.31 g/mol. Its IUPAC name is N'-benzylsulfonylfuran-2-carbohydrazide.

Molecular Properties

Compound NameN'-benzylsulfonylfuran-2-carbohydrazide
PubChem CID8515985
Molecular FormulaC12H12N2O4S
Molecular Weight280.31 g/mol
Exact Mass280.05
IUPAC NameN'-benzylsulfonylfuran-2-carbohydrazide
SMILESO=C(NNS(=O)(=O)Cc1ccccc1)c1ccco1
InChIInChI=1S/C12H12N2O4S/c15-12(11-7-4-8-18-11)13-14-19(16,17)9-10-5-2-1-3-6-10/h1-8,14H,9H2,(H,13,15)
InChIKeyRHGONPAXNNYYAG-UHFFFAOYSA-N
XLogP1.04
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 51.04
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

(benzylsulfonylamino)urea
CID 21225494
N'-(3,5-dichlorophenyl)sulfonylfuran-2-carbohydrazide
CID 8616927
N-[(2-chlorophenyl)methylsulfonyl]furan-2-carboxamide
CID 71859596
2-N'-(furan-2-carbonyl)-1-N'-phenylethanedihydrazide
CID 4646568
3-[(furan-2-carbonylamino)sulfamoyl]-4-methylbenzoic acid
CID 24502103
N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide
CID 110820123
N'-(2,5-dichlorophenyl)sulfonylfuran-2-carbohydrazide
CID 8616857
N-[(4-benzylsulfonylphenyl)carbamothioyl]furan-2-carboxamide
CID 148887016
furan-2-carboxylic acid;silver
CID 87285311
methyl N-(furan-2-carbonylamino)carbamate
CID 909545
N-chlorofuran-2-carboxamide
CID 18537247
N'-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)furan-2-carbohydrazide
CID 8616849

Frequently Asked Questions

What is the IUPAC name of N'-benzylsulfonylfuran-2-carbohydrazide?
The IUPAC name of N'-benzylsulfonylfuran-2-carbohydrazide (CID 8515985) is N'-benzylsulfonylfuran-2-carbohydrazide.
What is the SMILES notation for N'-benzylsulfonylfuran-2-carbohydrazide?
The canonical SMILES for N'-benzylsulfonylfuran-2-carbohydrazide is O=C(NNS(=O)(=O)Cc1ccccc1)c1ccco1.
What is the InChIKey of N'-benzylsulfonylfuran-2-carbohydrazide?
The InChIKey is RHGONPAXNNYYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4S/c15-12(11-7-4-8-18-11)13-14-19(16,17)9-10-5-2-1-3-6-10/h1-8,14H,9H2,(H,13,15).
What are the key properties of N'-benzylsulfonylfuran-2-carbohydrazide?
N'-benzylsulfonylfuran-2-carbohydrazide has a molecular weight of 280.31 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzylsulfonylfuran-2-carbohydrazide is sourced from PubChem (CID 8515985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).