Basic information
- CAS
1384265-26-2- Standard SMILES
FC(F)(F)c1cccc(CNc2nc(Cl)c3ncn(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3n2)c1- InChIKey
GOLSSYOPSKHULL-UHFFFAOYSA-N- Molecular formula
- C32H23ClF3N5
- Average molar mass
- 570 g/mol
- Monoisotopic mass
- 569.1594079
Names & identifiers
- Preferred name
- 6-Chloro-N-(3-(trifluoromethyl)benzyl)-9-trityl-9H-purin-2-amine
- IUPAC
- 6-chloro-N-[[3-(trifluoromethyl)phenyl]methyl]-9-tritylpurin-2-amine
Names & synonyms
6-CHLORO-N-(3-(TRIFLUOROMETHYL)BENZYL)-9-TRITYL-9H-PURIN-2-AMINE1384265-26-2MFCD225736456-chloro-N-[[3-(trifluoromethyl)phenyl]methyl]-9-tritylpurin-2-amine6-chloro-N-{[3-(trifluoromethyl)phenyl]methyl}-9-(triphenylmethyl)-9H-purin-2-amine9H-Purin-2-amine, 6-chloro-N-[[3-(trifluoromethyl)phenyl]methyl]-9-(triphenylmethyl)-C32H23ClF3N5DTXSID401127970AKOS027329328AS-36511CS-03342696-chloro-N-[[3-(trifluoromethyl)phenyl]methyl]-9-trityl-purin-2-amine
Database identifiers
- CAS
1384265-26-2- PubChem CID
- 71742003
- DTXSID
DTXSID401127970
Properties
Computed structural properties
- XLogP
- 8.5
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 781
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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