Basic information
- CAS
23515-38-0- Standard SMILES
Cc1cc(N2CN(C)CSC2=S)ccc1Br- InChIKey
AEESBQFCABUVNH-UHFFFAOYSA-N- Molecular formula
- C11H13BrN2S2
- Average molar mass
- 317.3 g/mol
- Monoisotopic mass
- 315.97035
Names & identifiers
- Preferred name
- 2H-1,3,5-Thiadiazine-2-thione, tetrahydro-3-(4-bromo-m-tolyl)-5-methyl-
- IUPAC
- 3-(4-bromo-3-methylphenyl)-5-methyl-1,3,5-thiadiazinane-2-thione
Names & synonyms
23515-38-02H-1,3,5-Thiadiazine-2-thione, tetrahydro-3-(4-bromo-m-tolyl)-5-methyl-Tetrahydro-3-(4-bromo-m-tolyl)-5-methyl-2H-1,3,5-thiadiazine-2-thioneDTXSID80178099RefChem:267751DTXCID601005903-(4-bromo-3-methylphenyl)-5-methyl-1,3,5-thiadiazinane-2-thione
Database identifiers
- CAS
23515-38-0- PubChem CID
- 211682
- DTXSID
DTXSID80178099
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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