Basic information
- CAS
68638-32-4- Standard SMILES
COc1ccc(N2CCN(Cn3cnc4ccccc4c3=O)CC2)cc1.Cl.Cl- InChIKey
FMAGAUPCKMFRJS-UHFFFAOYSA-N- Molecular formula
- C20H24Cl2N4O2
- Average molar mass
- 423.3 g/mol
- Monoisotopic mass
- 422.1276314
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(4-(p-methoxyphenyl)-1-piperazinylmethyl)-, dihydrochloride
- IUPAC
- 3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]quinazolin-4-one;dihydrochloride
Names & synonyms
4(3H)-Quinazolinone, 3-(4-(p-methoxyphenyl)-1-piperazinylmethyl)-, dihydrochloride68638-32-4DTXSID602187203-(4-(p-Anisyl)-1-piperazinylmethyl)-4(3H)-quinazolinone dihydrochloride3-(4-(p-Methoxyphenyl)-1-piperazinylmethyl)-4(3H)-quinazolinone dihydrochlorideRefChem:284068DTXCID101412113-{[4-(4-Methoxyphenyl)piperazin-1-yl]methyl}quinazolin-4(3H)-one--hydrogen chloride (1/2)
Database identifiers
- CAS
68638-32-4- PubChem CID
- 63503
- DTXSID
DTXSID60218720
Properties
Computed structural properties
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 510
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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