Basic information
- CAS
1645260-92-9- Standard SMILES
CC(=O)Nc1nc2c(s1)CC(O)CC2- InChIKey
ODWVXALVFVNASK-UHFFFAOYSA-N- Molecular formula
- C9H12N2O2S
- Average molar mass
- 212.27 g/mol
- Monoisotopic mass
- 212.0619488
Names & identifiers
- Preferred name
- N-(4,5,6,7-Tetrahydro-6-hydroxy-2-benzothiazolyl)acetamide
- IUPAC
- N-(6-hydroxy-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Names & synonyms
DTXSID901192122N-(4,5,6,7-Tetrahydro-6-hydroxy-2-benzothiazolyl)acetamideN-(6-Hydroxy-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide1645260-92-9
Database identifiers
- CAS
1645260-92-9- PubChem CID
- 84103751
- DTXSID
DTXSID901192122
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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