Basic information
- CAS
57381-66-5- Standard SMILES
CN1CN(C)CN(C(=S)c2c(Cl)cccc2Cl)C1- InChIKey
OCJHNOIMRJGTFI-UHFFFAOYSA-N- Molecular formula
- C12H15Cl2N3S
- Average molar mass
- 304.2 g/mol
- Monoisotopic mass
- 303.0363741
Names & identifiers
- Preferred name
- (2,6-Dichlorophenyl)-(3,5-dimethyl-1,3,5-triazinan-1-yl)methanethione
- IUPAC
- (2,6-dichlorophenyl)-(3,5-dimethyl-1,3,5-triazinan-1-yl)methanethione
Names & synonyms
57381-66-5NSC298247(2,6-dichlorophenyl)-(3,5-dimethyl-1,3,5-triazinan-1-yl)methanethioneDTXSID40315928NSC-298247(2,6-Dichlorophenyl)(3,5-dimethyl-1,3,5-triazinan-1-yl)methanethione
Database identifiers
- CAS
57381-66-5- PubChem CID
- 326581
- DTXSID
DTXSID40315928
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 296
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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