Basic information
- Standard SMILES
Clc1cccc(Nc2nc(Cl)nc3nc[nH]c23)c1- InChIKey
PGPQRKGCHHVFPY-UHFFFAOYSA-N- Molecular formula
- C11H7Cl2N5
- Average molar mass
- 280.11 g/mol
Names & identifiers
- Preferred name
- 2-chloro-N-(3-chlorophenyl)-9H-purin-6-amine
- IUPAC
- 2-chloro-N-(3-chlorophenyl)-7H-purin-6-amine
Names & synonyms
2-chloro-N-(3-chlorophenyl)-9H-purin-6-amine190654-76-39H-Purin-6-amine, 2-chloro-N-(3-chlorophenyl)-CHEMBL4547262-chloro-N-(3-chlorophenyl)-7H-purin-6-amineC11H7Cl2N5SCHEMBL3001568SCHEMBL3001570PGPQRKGCHHVFPY-UHFFFAOYSA-NCS-M18032-Chloro-6-(3-chloroanilino)purineBDBM50274501
Show more names
MFCD25372070AKOS037650267CS-145422-Chloro-6-(3-chloro-phenyl-amino)-purineC12509
Database identifiers
- PubChem CID
- 21988232
- ChEMBL
CHEMBL454726
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 293
Related reactions
8 records
Compound notes
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