Basic information
- CAS
30576-31-9- Standard SMILES
Nc1nc(Sc2ccc(Cl)cc2Cl)nc(C(Cl)(Cl)Cl)n1- InChIKey
WWZNGOACDZMMLN-UHFFFAOYSA-N- Molecular formula
- C10H5Cl5N4S
- Average molar mass
- 390.5 g/mol
- Monoisotopic mass
- 387.867756
Names & identifiers
- Preferred name
- 4-(2,4-Dichlorophenyl)sulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- 4-(2,4-dichlorophenyl)sulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
4-(2,4-dichlorophenyl)sulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine30576-31-9DTXSID202752984-[(2,4-dichlorophenyl)sulfanyl]-6-(trichloromethyl)-1,3,5-triazin-2-amine
Database identifiers
- CAS
30576-31-9- PubChem CID
- 35394
- DTXSID
DTXSID20275298- Nikkaji
- J1.614.291C
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 90 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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