Basic information
- CAS
62888-18-0- Standard SMILES
Cn1c(-c2ccccc2N=NN2CCCCC2)nc(=O)c2ccccc21- InChIKey
PQEYGWOPMKUFNP-UHFFFAOYSA-N- Molecular formula
- C20H21N5O
- Average molar mass
- 347.4 g/mol
- Monoisotopic mass
- 347.17461031
Names & identifiers
- Preferred name
- 1-Methyl-2-{2-[(E)-(piperidin-1-yl)diazenyl]phenyl}quinazolin-4(1H)-one
- IUPAC
- 1-methyl-2-[2-(piperidin-1-yldiazenyl)phenyl]quinazolin-4-one
Names & synonyms
62888-18-0NSC268898DTXSID803133221-Methyl-2-{2-[(E)-(piperidin-1-yl)diazenyl]phenyl}quinazolin-4(1H)-oneNSC-268898
Database identifiers
- CAS
62888-18-0- PubChem CID
- 320644
- DTXSID
DTXSID80313322
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 60.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 569
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…