Basic information
- CAS
116146-07-7- Standard SMILES
CC(C)(Nc1nc(Cl)nc(NC2CC2)n1)c1ccccc1- InChIKey
MSHDWULGEKUZMW-UHFFFAOYSA-N- Molecular formula
- C15H18ClN5
- Average molar mass
- 303.79 g/mol
- Monoisotopic mass
- 303.1250733
Names & identifiers
- Preferred name
- 1,3,5-Triazine-2,4-diamine, 6-chloro-4-N-cyclopropyl-2-N-(2-phenylpropan-2-yl)-
- IUPAC
- 6-chloro-4-N-cyclopropyl-2-N-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine
Names & synonyms
1,3,5-Triazine-2,4-diamine, 6-chloro-4-N-cyclopropyl-2-N-(2-phenylpropan-2-yl)-116146-07-76-chloro-4-N-cyclopropyl-2-N-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamineDTXSID501512936-Chloro-N~2~-cyclopropyl-N~4~-(2-phenylpropan-2-yl)-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
116146-07-7- PubChem CID
- 189367
- DTXSID
DTXSID50151293
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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