Benzyl 5-aminosulfonyl-4-chloro-2-[(2-furanylmethyl)amino]benzoate

HCID 11697463

Completing data — usually done within a minute

Basic information

CAS
885051-42-3
Standard SMILES
NS(=O)(=O)c1cc(C(=O)OCc2ccccc2)c(NCc2ccco2)cc1Cl
InChIKey
CLRZNRZEVZOSOW-UHFFFAOYSA-N
Molecular formula
C19H17ClN2O5S
Average molar mass
420.9 g/mol
Monoisotopic mass
420.0546705

Names & identifiers

Preferred name
Benzyl 5-aminosulfonyl-4-chloro-2-[(2-furanylmethyl)amino]benzoate
IUPAC
benzyl 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoate

Names & synonyms

885051-42-3SCHEMBL230206CLRZNRZEVZOSOW-UHFFFAOYSA-NDTXSID601145396benzyl 5-aminosulfonyl-4-chloro-2-[(2-furanylmethyl)amino]benzoateDB-429543benzyl 4-chloro-2-((furan-2-ylmethyl)amino)-5-sulfamoylbenzoateBenzyl 4-chloro-2-{[(furan-2-yl)methyl]amino}-5-sulfamoylbenzoatePhenylmethyl 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoate

Database identifiers

CAS
885051-42-3
PubChem CID
11697463
DTXSID
DTXSID601145396

Properties

Computed structural propertiesFilling in

XLogP
3.9
Topological polar surface area
120 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
28

Related reactions

2 records

Compound notes

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