Basic information
- CAS
134563-05-6- Standard SMILES
COc1ccc(C(=O)CCn2cnc3ccccc3c2=O)cc1- InChIKey
PYHAEMUIQKJBKD-UHFFFAOYSA-N- Molecular formula
- C18H16N2O3
- Average molar mass
- 308.3 g/mol
- Monoisotopic mass
- 308.11609238
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(3-(4-methoxyphenyl)-3-oxopropyl)-
- IUPAC
- 3-[3-(4-methoxyphenyl)-3-oxopropyl]quinazolin-4-one
Names & synonyms
BRN 53485164(3H)-Quinazolinone, 3-(3-(4-methoxyphenyl)-3-oxopropyl)-134563-05-63-(3-(4-Methoxyphenyl)-3-oxopropyl)-4(3H)-quinazolinoneDTXSID20158794RefChem:284038DTXCID30812853-[3-(4-methoxyphenyl)-3-oxopropyl]quinazolin-4(3h)-one
Database identifiers
- CAS
134563-05-6- PubChem CID
- 63996
- DTXSID
DTXSID20158794
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 469
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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