Basic information
- CAS
77161-22-9- Standard SMILES
Cc1ccccc1-n1c(CN2CCOCC2)nc2c(Br)cc(Br)cc2c1=O- InChIKey
XPPUDUUGXAPWRL-UHFFFAOYSA-N- Molecular formula
- C20H19Br2N3O2
- Average molar mass
- 493.2 g/mol
- Monoisotopic mass
- 490.9844
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6,8-dibromo-3-(2-methylphenyl)-2-(4-morpholinylmethyl)-
- IUPAC
- 6,8-dibromo-3-(2-methylphenyl)-2-(morpholin-4-ylmethyl)quinazolin-4-one
Names & synonyms
77161-22-94(3H)-Quinazolinone, 6,8-dibromo-3-(2-methylphenyl)-2-(4-morpholinylmethyl)-6,8-Dibromo-3-(2-methylphenyl)-2-(4-morpholinylmethyl)-4(3H)-quinazolinoneDTXSID90227921RefChem:284223DTXCID401504126,8-Dibromo-3-(2-methylphenyl)-2-[(morpholin-4-yl)methyl]quinazolin-4(3H)-one
Database identifiers
- CAS
77161-22-9- PubChem CID
- 63592
- DTXSID
DTXSID90227921
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 582
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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