Basic information
- Standard SMILES
COc1cc(S(=O)(=O)N(C)C)ccc1-c1nc2ncncc2[nH]1.Cl- InChIKey
MSLQPFUDIODFPM-UHFFFAOYSA-N- Molecular formula
- C14H16ClN5O3S
- Average molar mass
- 369.8 g/mol
- Monoisotopic mass
- 369.0662383
Names & identifiers
- Preferred name
- 8-(2'-Methoxy-4'-dimethylaminosulfonyl-phenyl)-purine hydrochloride
- IUPAC
- 3-methoxy-N,N-dimethyl-4-(7H-purin-8-yl)benzenesulfonamide;hydrochloride
Names & synonyms
SCHEMBL10748007MSLQPFUDIODFPM-UHFFFAOYSA-N8-(2'-Methoxy-4'-dimethylaminosulfonyl-phenyl)-purine hydrochloride
Database identifiers
- PubChem CID
- 20184581
Properties
Computed structural properties
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 509
Related reactions
2 records
Compound notes
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