2-amino-4-(2-hydroxy-5-methylphenyl)-4,5-dihydro-1H-pyrimidin-6-one
Basic information
- CAS
68845-89-6- Standard SMILES
Cc1ccc(O)c(C2CC(=O)NC(N)=N2)c1- InChIKey
RHGIZRPOIZIHSA-UHFFFAOYSA-N- Molecular formula
- C11H13N3O2
- Average molar mass
- 219.24 g/mol
- Monoisotopic mass
- 219.10077667
Names & identifiers
- Preferred name
- 2-amino-4-(2-hydroxy-5-methylphenyl)-4,5-dihydro-1H-pyrimidin-6-one
- IUPAC
- 2-amino-4-(2-hydroxy-5-methylphenyl)-4,5-dihydro-1H-pyrimidin-6-one
Names & synonyms
68845-89-6NSC2922872-amino-4-(2-hydroxy-5-methylphenyl)-4,5-dihydro-1H-pyrimidin-6-oneCHEMBL2396931DTXSID80315149NSC-2922872-Amino-6-(2-hydroxy-5-methylphenyl)-5,6-dihydropyrimidin-4(3H)-one
Database identifiers
- CAS
68845-89-6- PubChem CID
- 325020
- DTXSID
DTXSID80315149- ChEMBL
CHEMBL2396931
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…