Basic information
- Standard SMILES
CC(C)Cn1c(N)c(N)c(=O)[nH]c1=S- InChIKey
YUMMJRDPNNJVEX-UHFFFAOYSA-N- Molecular formula
- C8H14N4OS
- Average molar mass
- 214.29 g/mol
Names & identifiers
- Preferred name
- 5,6-Diamino-1-isobutyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one
- IUPAC
- 5,6-diamino-1-(2-methylpropyl)-2-sulfanylidenepyrimidin-4-one
Names & synonyms
5,6-Diamino-1-isobutyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-oneSCHEMBL1958856YUMMJRDPNNJVEX-UHFFFAOYSA-N618913-35-2DB-332754
Database identifiers
- PubChem CID
- 86601050
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 310
Related reactions
7 records
Compound notes
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