1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-propyl-
Basic information
- CAS
103427-72-1- Standard SMILES
CCCNc1nc(NC(C)C)nc(SC(F)F)n1- InChIKey
ZDJQBYRPCFRUEW-UHFFFAOYSA-N- Molecular formula
- C10H17F2N5S
- Average molar mass
- 277.34 g/mol
- Monoisotopic mass
- 277.11727306
Names & identifiers
- Preferred name
- 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-propyl-
- IUPAC
- 6-(difluoromethylsulfanyl)-2-N-propan-2-yl-4-N-propyl-1,3,5-triazine-2,4-diamine
Names & synonyms
1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-propyl-103427-72-1DTXSID90908389ZDJQBYRPCFRUEW-UHFFFAOYSA-N6-[(Difluoromethyl)sulfanyl]-N~2~-(propan-2-yl)-N~4~-propyl-1,3,5-triazine-2,4(1H,3H)-diimine
Database identifiers
- CAS
103427-72-1- PubChem CID
- 190519
- DTXSID
DTXSID90908389
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 88 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 232
Experimental & physicochemical properties
LogP4.23
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Compound notes
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