Basic information
- CAS
59808-54-7- Standard SMILES
Cc1ncc(NC(=O)C(=O)Nc2cnc(C)nc2)cn1- InChIKey
ZETLEXQDLUSPKC-UHFFFAOYSA-N- Molecular formula
- C12H12N6O2
- Average molar mass
- 272.26 g/mol
- Monoisotopic mass
- 272.10217365
Names & identifiers
- Preferred name
- Ethanediamide, N,N'-bis(2-methyl-5-pyrimidinyl)-
- IUPAC
- N,N'-bis(2-methylpyrimidin-5-yl)oxamide
Names & synonyms
59808-54-7N,N'-bis(2-methylpyrimidin-5-yl)oxamideEthanediamide, N,N'-bis(2-methyl-5-pyrimidinyl)-N1,N1-Bis(2-methylpyrimidin-5-yl)oxalamideDTXSID90385272N~1~,N~2~-Bis(2-methylpyrimidin-5-yl)ethanediamide
Database identifiers
- CAS
59808-54-7- PubChem CID
- 2830173
- DTXSID
DTXSID90385272
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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