6-Chloro-5-(2-hydroxyethyl)-4-(methylamino)-1-phenylpyrimidin-2-one
Basic information
- CAS
63412-47-5- Standard SMILES
CNc1nc(=O)n(-c2ccccc2)c(Cl)c1CCO- InChIKey
MYWCOUZOYBLGMF-UHFFFAOYSA-N- Molecular formula
- C13H14ClN3O2
- Average molar mass
- 279.72 g/mol
- Monoisotopic mass
- 279.0774544
Names & identifiers
- Preferred name
- 6-Chloro-5-(2-hydroxyethyl)-4-(methylamino)-1-phenylpyrimidin-2-one
- IUPAC
- 6-chloro-5-(2-hydroxyethyl)-4-(methylamino)-1-phenylpyrimidin-2-one
Names & synonyms
63412-47-5NSC2947636-chloro-5-(2-hydroxyethyl)-4-(methylamino)-1-phenylpyrimidin-2-oneDTXSID30315472NSC-2947636-Chloro-5-(2-hydroxyethyl)-4-(methylamino)-1-phenylpyrimidin-2(1H)-one
Database identifiers
- CAS
63412-47-5- PubChem CID
- 325670
- DTXSID
DTXSID30315472
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…