Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
O=S1N=Cc2ncccc21- InChIKey
KTCVCBVCELZAPG-UHFFFAOYSA-N- Molecular formula
- C6H4N2OS
- Average molar mass
- 152.18 g/mol
- Monoisotopic mass
- 152.00443393
Names & identifiers
- Preferred name
- Pyridinoisothiazolone
- IUPAC
- [1,2]thiazolo[4,5-b]pyridine 1-oxide
Names & synonyms
pyridoisothiazolonepyridinoisothiazoloneSCHEMBL88910KTCVCBVCELZAPG-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 57790288
Properties
Computed structural propertiesFilling in
- XLogP
- -0.3
- Topological polar surface area
- 61.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 192
Related reactions
1 records
Compound notes
Loading…