Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
O=C(O)C1(c2cccnc2)NC=CS1- InChIKey
MFGLVMYQBPVWDM-UHFFFAOYSA-N- Molecular formula
- C9H8N2O2S
- Average molar mass
- 208.24 g/mol
- Monoisotopic mass
- 208.03064868
Names & identifiers
- Preferred name
- 2-(3-Pyridyl)-thiazolecarboxylic acid
- IUPAC
- 2-pyridin-3-yl-3H-1,3-thiazole-2-carboxylic acid
Names & synonyms
SCHEMBL4765677MFGLVMYQBPVWDM-UHFFFAOYSA-N2-(3-pyridyl)-thiazolecarboxylic acid2-(3-pyridyl)-1,3-thiazole carboxylic acid
Database identifiers
- PubChem CID
- 69180263
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 87.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 270
Related reactions
1 records
Compound notes
Loading…