N'-(6-methoxy-1,3-benzothiazol-2-yl)-N,N-dimethylmethanimidamide
Basic information
- CAS
5618-93-9- Standard SMILES
COc1ccc2nc(N=CN(C)C)sc2c1- InChIKey
BPQXVNLXHZYSPG-UHFFFAOYSA-N- Molecular formula
- C11H13N3OS
- Average molar mass
- 235.31 g/mol
- Monoisotopic mass
- 235.07793322
Names & identifiers
- Preferred name
- N'-(6-methoxy-1,3-benzothiazol-2-yl)-N,N-dimethylmethanimidamide
- IUPAC
- N'-(6-methoxy-1,3-benzothiazol-2-yl)-N,N-dimethylmethanimidamide
Names & synonyms
5618-93-9N'-(6-methoxy-1,3-benzothiazol-2-yl)-N,N-dimethylmethanimidamideOprea1_217196DTXSID40971563HMS2352F19EU-0001400Q27186408
Database identifiers
- CAS
5618-93-9- PubChem CID
- 380199
- DTXSID
DTXSID40971563
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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