4-phenyl-N-propyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Basic information
- CAS
24803-01-8- Standard SMILES
CCCNc1nc(-c2ccccc2)nc(C(Cl)(Cl)Cl)n1- InChIKey
UEUPRZCTPBMDAE-UHFFFAOYSA-N- Molecular formula
- C13H13Cl3N4
- Average molar mass
- 331.6 g/mol
- Monoisotopic mass
- 330.02058
Names & identifiers
- Preferred name
- 4-phenyl-N-propyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- 4-phenyl-N-propyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
4-phenyl-N-propyl-6-(trichloromethyl)-1,3,5-triazin-2-amine24803-01-8CHEMBL2286855DTXSID90274975
Database identifiers
- CAS
24803-01-8- PubChem CID
- 32631
- DTXSID
DTXSID90274975- ChEMBL
CHEMBL2286855- Nikkaji
- J1.611.481B
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 292
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Compound notes
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