Basic information
- Standard SMILES
COCC1NCCN(Cc2ccc3c(N)ncnc3c2)C1=O- InChIKey
HDCLQBCLRJGSGR-UHFFFAOYSA-N- Molecular formula
- C15H19N5O2
- Average molar mass
- 301.34 g/mol
- Monoisotopic mass
- 301.15387487
Names & identifiers
- Preferred name
- 1-(4-Amino-quinazoline-7-ylmethyl)-3-methoxymethyl-piperazine-2-one
- IUPAC
- 1-[(4-aminoquinazolin-7-yl)methyl]-3-(methoxymethyl)piperazin-2-one
Names & synonyms
SCHEMBL1654483HDCLQBCLRJGSGR-UHFFFAOYSA-N1-(4-amino-quinazoline-7-ylmethyl)-3-methoxymethyl-piperazine-2-one
Database identifiers
- PubChem CID
- 17985223
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
Related reactions
5 records
Compound notes
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