5-(4-Chlorophenyl)-6-ethyl-3-hydroxy-2-imino-pyrimidin-4-amine
Basic information
- CAS
91284-15-0- Standard SMILES
CCc1nc(=N)n(O)c(N)c1-c1ccc(Cl)cc1- InChIKey
LXERYRMYNXJFNA-UHFFFAOYSA-N- Molecular formula
- C12H13ClN4O
- Average molar mass
- 264.71 g/mol
- Monoisotopic mass
- 264.0777887
Names & identifiers
- Preferred name
- 5-(4-Chlorophenyl)-6-ethyl-3-hydroxy-2-imino-pyrimidin-4-amine
- IUPAC
- 5-(4-chlorophenyl)-6-ethyl-3-hydroxy-2-iminopyrimidin-4-amine
Names & synonyms
91284-15-05-(4-chlorophenyl)-6-ethyl-3-hydroxy-2-imino-pyrimidin-4-amine6-Amino-5-(4-chlorophenyl)-4-ethyl-2-iminopyrimidin-1(2H)-olPyrimethamine N3-Oxide5-(4-chlorophenyl)-6-ethyl-3-hydroxy-2-iminopyrimidin-4-aminePyrimethamine Impurity 7DTXSID909198592,4-Pyrimidinediamine, 5-(4-chlorophenyl)-6-ethyl-, 3-oxide2,6-diamino-5-(4-chlorophenyl)-4-ethylpyrimidine 1-oxide2,6-diamino-5-(3-amino-4-chlorophenyl)-4-ethylpyrimidine 1-oxide
Database identifiers
- CAS
91284-15-0- PubChem CID
- 185100
- DTXSID
DTXSID90919859
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 85.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 410
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…