2,6-Diaminopurine sulfate
Basic information
- CAS
7280-83-3- Standard SMILES
Nc1nc(N)c2[nH]cnc2n1.O=S(=O)(O)O- InChIKey
KYYLASPNTMEZTB-UHFFFAOYSA-N- Molecular formula
- C5H8N6O4S
- Average molar mass
- 248.22 g/mol
- Monoisotopic mass
- 248.03277393
Names & identifiers
- Preferred name
- 2,6-Diaminopurine sulfate
- IUPAC
- 7H-purine-2,6-diamine;sulfuric acid
- English name
- 2,6-Diaminopurine sulfate
- Molecular formula
- C5H8N6O4S
- Molecular weight
- 248.22
Names & synonyms
2,6-Diaminopurine sulfateRefChem:1082567280-83-31H-Purine-2,6-diamine, sulfate9H-Purine-2,6-diamine sulfate7H-Purine-2,6-diamine sulfatePurine-2,6-diyldiamine sulphatePurine, 2,6-diamino-, sulfateEINECS 230-697-92-6 DPAI3-504387H-purine-2,6-diamine; sulfuric acid
Show more names
2,6-diamino-purinsulfate1h-purine-2,6-diamine,sulfate9H-Purine-2,6-diamine, sulfate (1:)
9H-Purine-2,6-diamine, sulfate (1:?)9H-purine-2,6-diamine; sulfuric acidSCHEMBL4535059SCHEMBL7659157DTXSID6064612SCHEMBL30680639NSC240560NSC-240560
Database identifiers
- CAS
7280-83-3- PubChem CID
- 81695
- DTXSID
DTXSID6064612- ChEMBL
CHEMBL1788357- EC Number
- 230-697-9
Properties
Computed structural properties
- Topological polar surface area
- 189 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 1 H-Purine-2,6-diamine, · 1H-Purine-2,6-diamine, sulfate (7280-83-3)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationCompounds that inhibit cell production of DNA or RNA.
Uses & manufacturing
General Manufacturing Information9H-Purine-2,6-diamine, sulfate (1:?): INACTIVE
Related reactions
1 records
Compound notes
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