Basic information
- CAS
32267-39-3- Standard SMILES
NC1=NC(N)C(=O)C(=O)N1- InChIKey
NVANETMVFYSFSK-UHFFFAOYSA-N- Molecular formula
- C4H6N4O2
- Average molar mass
- 142.12 g/mol
- Monoisotopic mass
- 142.04907545
Names & identifiers
- Preferred name
- 4,5-Pyrimidinedione, 2,6-diamino-1,6-dihydro-
- IUPAC
- 2,4-diamino-1,4-dihydropyrimidine-5,6-dione
Names & synonyms
4,5-Pyrimidinedione, 2,6-diamino-1,6-dihydro-UNII-1I0JQQ440Q4,5-Pyrimidinedione, 2,6-diamino-1,6-dihydro- (9CI)DB-2722572,6-diamino-3,6-dihydropyrimidine-4,5-dione
Database identifiers
- CAS
32267-39-3- PubChem CID
- 91606
- Nikkaji
- J18.114E
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 221
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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