1,5,6,7-Tetrahydropyrrolo[3,4-d]pyrimidine-4-thione;hydrochloride
Basic information
- CAS
13925-31-0- Standard SMILES
Cl.S=c1nc[nH]c2c1CNC2- InChIKey
YBWXVZCAUWSBTH-UHFFFAOYSA-N- Molecular formula
- C6H8ClN3S
- Average molar mass
- 189.67 g/mol
- Monoisotopic mass
- 189.0127461
Names & identifiers
- Preferred name
- 1,5,6,7-Tetrahydropyrrolo[3,4-d]pyrimidine-4-thione;hydrochloride
- IUPAC
- 1,5,6,7-tetrahydropyrrolo[3,4-d]pyrimidine-4-thione;hydrochloride
Names & synonyms
13925-31-0DTXSID20712633NSC116524NSC-1165241,5,6,7-Tetrahydro-4H-pyrrolo[3,4-d]pyrimidine-4-thione--hydrogen chloride (1/1)
Database identifiers
- CAS
13925-31-0- PubChem CID
- 54599094
- DTXSID
DTXSID20712633
Properties
Computed structural properties
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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