6-(4-amino-3-methylanilino)-1H-pyrimidine-2,4-dione
Basic information
- CAS
72255-63-1- Standard SMILES
Cc1cc(Nc2cc(=O)[nH]c(=O)[nH]2)ccc1N- InChIKey
HTNZTLICIWTAFB-UHFFFAOYSA-N- Molecular formula
- C11H12N4O2
- Average molar mass
- 232.24 g/mol
- Monoisotopic mass
- 232.09602564
Names & identifiers
- Preferred name
- 6-(4-amino-3-methylanilino)-1H-pyrimidine-2,4-dione
- IUPAC
- 6-(4-amino-3-methylanilino)-1H-pyrimidine-2,4-dione
Names & synonyms
CHEMBL5453072255-63-16-(4-amino-3-methylanilino)-1H-pyrimidine-2,4-dioneNSC375965DTXSID30321452BDBM50028354NSC-3759656-(4-Amino-3-methyl-phenylamino)-1H-pyrimidine-2,4-dione6-(4-Amino-3-methylanilino)pyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
72255-63-1- PubChem CID
- 341856
- DTXSID
DTXSID30321452- ChEMBL
CHEMBL54530
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 96.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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