Basic information
- CAS
312523-03-8- Standard SMILES
CC1CN(Cn2nc(-c3ccccc3Cl)oc2=S)CC(C)O1- InChIKey
WEFGLSFZGVCOSV-UHFFFAOYSA-N- Molecular formula
- C15H18ClN3O2S
- Average molar mass
- 339.8 g/mol
- Monoisotopic mass
- 339.0808257
Names & identifiers
- Preferred name
- 5-(2-Chlorophenyl)-3-((2,6-dimethyl-4-morpholinyl)methyl)-1,3,4-oxadiazole-2(3H)-thione
- IUPAC
- 5-(2-chlorophenyl)-3-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-oxadiazole-2-thione
Names & synonyms
5-(2-Chlorophenyl)-3-[(2,6-dimethyl-4-morpholinyl)methyl]-1,3,4-oxadiazole-2(3H)-thione312523-03-85-(2-Chlorophenyl)-3-((2,6-dimethyl-4-morpholinyl)methyl)-1,3,4-oxadiazole-2(3H)-thioneRefChem:2994275-(2-chlorophenyl)-3-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-oxadiazole-2(3H)-thioneOprea1_179385DTXSID401125279STK027033AKOS005380421AG-205/122301185-(2-chlorophenyl)-3-((2,6-dimethylmorpholino)methyl)-1,3,4-oxadiazole-2(3H)-thione
Database identifiers
- CAS
312523-03-8- PubChem CID
- 3535367
- DTXSID
DTXSID401125279
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 452
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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