4-methylsulfanyl-N-propan-2-yl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Basic information
- CAS
30369-44-9- Standard SMILES
CSc1nc(NC(C)C)nc(C(Cl)(Cl)Cl)n1- InChIKey
RGPUFWXEWZBAPJ-UHFFFAOYSA-N- Molecular formula
- C8H11Cl3N4S
- Average molar mass
- 301.6 g/mol
- Monoisotopic mass
- 299.977001
Names & identifiers
- Preferred name
- 4-methylsulfanyl-N-propan-2-yl-6-(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- 4-methylsulfanyl-N-propan-2-yl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
4-methylsulfanyl-N-propan-2-yl-6-(trichloromethyl)-1,3,5-triazin-2-amine30369-44-9DTXSID402752704-(methylsulfanyl)-N-(propan-2-yl)-6-(trichloromethyl)-1,3,5-triazin-2-amine
Database identifiers
- CAS
30369-44-9- PubChem CID
- 35260
- DTXSID
DTXSID40275270- Nikkaji
- J1.614.202F
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 224
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Compound notes
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