Basic information
- CAS
23515-34-6- Standard SMILES
CCN1CSC(=S)N(c2ccc(Br)c(Cl)c2)C1- InChIKey
OALHFIXAHPNEBT-UHFFFAOYSA-N- Molecular formula
- C11H12BrClN2S2
- Average molar mass
- 351.7 g/mol
- Monoisotopic mass
- 349.93138
Names & identifiers
- Preferred name
- 2H-1,3,5-Thiadiazine-2-thione, tetrahydro-3-(4-bromo-3-chlorophenyl)-5-ethyl-
- IUPAC
- 3-(4-bromo-3-chlorophenyl)-5-ethyl-1,3,5-thiadiazinane-2-thione
Names & synonyms
23515-34-62H-1,3,5-Thiadiazine-2-thione, tetrahydro-3-(4-bromo-3-chlorophenyl)-5-ethyl-Tetrahydro-3-(4-bromo-3-chlorophenyl)-5-ethyl-2H-1,3,5-thiadiazine-2-thioneDTXSID60178097RefChem:267747DTXCID901005883-(4-bromo-3-chlorophenyl)-5-ethyl-1,3,5-thiadiazinane-2-thione
Database identifiers
- CAS
23515-34-6- PubChem CID
- 211679
- DTXSID
DTXSID60178097
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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