Basic information
- CAS
54-19-3- Standard SMILES
Nc1nc(=S)c(N)c(N)[nH]1- InChIKey
BKWNMYAKKPLPFE-UHFFFAOYSA-N- Molecular formula
- C4H7N5S
- Average molar mass
- 157.2 g/mol
- Monoisotopic mass
- 157.04221642
Names & identifiers
- Preferred name
- 2,5,6-Triaminopyrimidine-4(3H)-thione
- IUPAC
- 2,5,6-triamino-1H-pyrimidine-4-thione
- English name
- 2,5,6-TriaMinopyriMidine-4(3H)-thione
- Molecular formula
- C4H7N5S
- Molecular weight
- 157.2
Names & synonyms
2,5,6-Triaminopyrimidine-4(3H)-thione54-19-32,5,6-TRIAMINO-1H-PYRIMIDINE-4-THIONESCHEMBL3675738DTXSID30495324SB569952,5,6-Triaminopyrimidine-4(1H)-thione5-Br-2'-deoxyuridine2,5,6-triamino-3H-pyrimidine-4-thione4(3H)-Pyrimidinethione, 2,5,6-triamino-
Database identifiers
- CAS
54-19-3- PubChem CID
- 12379025
- DTXSID
DTXSID30495324
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 240
Chemistry & industry
Suppliers1 total
上海书亚医药科技有限公司400-685-9117 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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