Basic information
- Standard SMILES
CCOC(=O)CNC(=O)Nc1ccc(Cl)c(S(N)(=O)=O)c1O- InChIKey
ACCLNEUYGXYKPN-UHFFFAOYSA-N- Molecular formula
- C11H14ClN3O6S
- Average molar mass
- 351.76 g/mol
Names & identifiers
- Preferred name
- N-(3-aminosulfonyl-4-chloro-2-hydroxyphenyl)-N'-(ethoxycarbonyl)methylurea
- IUPAC
- ethyl 2-[(4-chloro-2-hydroxy-3-sulfamoylphenyl)carbamoylamino]acetate
Names & synonyms
SCHEMBL4604578ACCLNEUYGXYKPN-UHFFFAOYSA-NN-(3-aminosulfonyl-4-chloro-2-hydroxyphenyl)-N'-(ethoxycarbonyl)methylurea
Database identifiers
- PubChem CID
- 10154964
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 508
Related reactions
2 records
Compound notes
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