Basic information
- CAS
873410-84-5- Standard SMILES
NC(=O)CSc1nc(N)nc(N)n1- InChIKey
KKBHEOUYTABNFG-UHFFFAOYSA-N- Molecular formula
- C5H8N6OS
- Average molar mass
- 200.22 g/mol
- Monoisotopic mass
- 200.04803007
Names & identifiers
- Preferred name
- 2-[(4,6-Diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide
- IUPAC
- 2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide
Names & synonyms
2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide873410-84-5DTXSID50873524HMS1740O19AKOS033580698alpha-(4,6-Diamino-s-triazin-2-ylmercapto)-acetamideZ17559442
Database identifiers
- CAS
873410-84-5- PubChem CID
- 459159
- DTXSID
DTXSID50873524
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 180
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…