Basic information
- Standard SMILES
CCNC(=O)Nc1nc2ccc(C(=O)O)cc2s1- InChIKey
WGZBSKAESORCGC-UHFFFAOYSA-N- Molecular formula
- C11H11N3O3S
- Average molar mass
- 265.29 g/mol
Names & identifiers
- Preferred name
- 2-[(Ethylamino)Carbonyl]amino-1,3-benzothiazole-6-carboxylic acid
- IUPAC
- 2-(ethylcarbamoylamino)-1,3-benzothiazole-6-carboxylic acid
Names & synonyms
SCHEMBL4746047WGZBSKAESORCGC-UHFFFAOYSA-NAKOS0146842122-[(Ethylamino)Carbonyl]amino-1,3-benzothiazole-6-carboxylic acid
Database identifiers
- PubChem CID
- 65348776
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 339
Related reactions
2 records
Compound notes
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