Basic information
- CAS
116145-91-6- Standard SMILES
CNc1nc(Cl)nc(NC(C)(C)c2ccccc2)n1- InChIKey
JGWMESCWCOMKKH-UHFFFAOYSA-N- Molecular formula
- C13H16ClN5
- Average molar mass
- 277.75 g/mol
- Monoisotopic mass
- 277.1094232
Names & identifiers
- Preferred name
- 6-chloro-4-N-methyl-2-N-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine
- IUPAC
- 6-chloro-4-N-methyl-2-N-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine
Names & synonyms
6-chloro-4-N-methyl-2-N-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine116145-91-6DTXSID301512916-Chloro-N~2~-methyl-N~4~-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
116145-91-6- PubChem CID
- 189355
- DTXSID
DTXSID30151291
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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