Basic information
- Standard SMILES
Cc1ccc([N+](=O)[O-])cc1N1CCc2nc(N)ncc2C1=O- InChIKey
KOZBRHBUOXMYFC-UHFFFAOYSA-N- Molecular formula
- C14H13N5O3
- Average molar mass
- 299.28 g/mol
Names & identifiers
- Preferred name
- 2-Amino-6-(2-methyl-5-nitro-phenyl)-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
- IUPAC
- 2-amino-6-(2-methyl-5-nitrophenyl)-7,8-dihydropyrido[4,3-d]pyrimidin-5-one
Names & synonyms
SCHEMBL2237025KOZBRHBUOXMYFC-UHFFFAOYSA-N2-Amino-6-(2-methyl-5-nitro-phenyl)-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
Database identifiers
- PubChem CID
- 67329142
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 454
Related reactions
3 records
Compound notes
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