Basic information
- Standard SMILES
Cc1nc(C(=O)O)c(Nc2cccnc2)s1- InChIKey
BFHCZRFOIXUVMK-UHFFFAOYSA-N- Molecular formula
- C10H9N3O2S
- Average molar mass
- 235.26 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-5-(pyridin-3-ylamino)-thiazole-4-carboxylic acid
- IUPAC
- 2-methyl-5-(pyridin-3-ylamino)-1,3-thiazole-4-carboxylic acid
Names & synonyms
SCHEMBL2826680BFHCZRFOIXUVMK-UHFFFAOYSA-N2-methyl-5-(pyridin-3-ylamino)-thiazole-4-carboxylic acid
Database identifiers
- PubChem CID
- 68406090
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 264
Related reactions
2 records
Compound notes
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