Basic information
- CAS
134563-07-8- Standard SMILES
COc1ccc(C(=O)CCn2cnc3ccccc3c2=O)cc1OC- InChIKey
HUHNTPUIWSQBPF-UHFFFAOYSA-N- Molecular formula
- C19H18N2O4
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.12665706
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(3-(3,4-dimethoxyphenyl)-3-oxopropyl)-
- IUPAC
- 3-[3-(3,4-dimethoxyphenyl)-3-oxopropyl]quinazolin-4-one
Names & synonyms
BRN 53528734(3H)-Quinazolinone, 3-(3-(3,4-dimethoxyphenyl)-3-oxopropyl)-134563-07-83-(3-(3,4-Dimethoxyphenyl)-3-oxopropyl)-4(3H)-quinazolinoneDTXSID40158796RefChem:284035DTXCID30812873-[3-(3,4-dimethoxyphenyl)-3-oxopropyl]quinazolin-4(3h)-one
Database identifiers
- CAS
134563-07-8- PubChem CID
- 63997
- DTXSID
DTXSID40158796
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 522
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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