Basic information
- CAS
27078-87-1- Standard SMILES
Nc1cc(Nc2ccccc2)nc(=O)[nH]1- InChIKey
STUWEJLHBZGVES-UHFFFAOYSA-N- Molecular formula
- C10H10N4O
- Average molar mass
- 202.21 g/mol
- Monoisotopic mass
- 202.08546096
Names & identifiers
- Preferred name
- 4-Amino-6-(phenylamino)-2(1H)-pyrimidinone
- IUPAC
- 6-amino-4-anilino-1H-pyrimidin-2-one
Names & synonyms
27078-87-1RefChem:2900164-Amino-6-(phenylamino)-2(1H)-pyrimidinoneNSC211608NSC 211608Oprea1_567032CHEMBL32736684-amino-6-anilino-2-pyrimidinolDTXSID10309278NSC-2116086-Amino-4-anilinopyrimidin-2(1H)-oneAB-323/13887041
Database identifiers
- CAS
27078-87-1- PubChem CID
- 309337
- DTXSID
DTXSID10309278- ChEMBL
CHEMBL3273668
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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