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N-(4-Methoxybenzylidene)-4-sulfamoylaniline

HCID 625902
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Basic information

CAS
66667-56-9
Standard SMILES
COc1ccc(C=Nc2ccc(S(N)(=O)=O)cc2)cc1
InChIKey
MLUHDVSELBSKPI-UHFFFAOYSA-N
Molecular formula
C14H14N2O3S
Average molar mass
290.34 g/mol
Monoisotopic mass
290.07251349

Names & identifiers

Preferred name
N-(4-Methoxybenzylidene)-4-sulfamoylaniline
IUPAC
4-[(4-methoxyphenyl)methylideneamino]benzenesulfonamide

Names & synonyms

N-(4-Methoxybenzylidene)-4-sulfamoylanilineCHEMBL2719111268249-71-34-[(4-Methoxybenzylidene)amino]benzenesulfonamide4-((4-METHOXYBENZYLIDENE)AMINO)BENZENESULFONAMIDE66667-56-9Uyi C16CBDivE_014997SCHEMBL1517619SCHEMBL5308961DTXSID70347792MLUHDVSELBSKPI-MHWRWJLKSA-N
Show more names
MLUHDVSELBSKPI-UHFFFAOYSA-N4-{[(4-methoxyphenyl)methylidene]amino}benzene-1-sulfonamideBDBM50371762STK790787AKOS001583663PD181781PD181782ST016434

Database identifiers

CAS
66667-56-9
PubChem CID
625902
DTXSID
DTXSID70347792
ChEMBL
CHEMBL271911
Nikkaji
J759.484D

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
90.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
414

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Related reactions

4 records
New reaction record
HRID 152241 reaction equation
HRID 152241As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 856836 reaction equation
HRID 856836As productuspto-grants-2006_12
HRID 1415773 reaction equation
HRID 1415773As productuspto-grants-1999_06
HRID 1415774 reaction equation
HRID 1415774As reactantuspto-grants-1999_06

Compound notes

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