4(3H)-Quinazolinone, 6-iodo-2-((4-methylphenyl)methoxy)-3-(2-pyridinyl)-
Basic information
- CAS
85178-77-4- Standard SMILES
Cc1ccc(COc2nc3ccc(I)cc3c(=O)n2-c2ccccn2)cc1- InChIKey
WITVHZAQJYUXHX-UHFFFAOYSA-N- Molecular formula
- C21H16IN3O2
- Average molar mass
- 469.3 g/mol
- Monoisotopic mass
- 469.02872
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-iodo-2-((4-methylphenyl)methoxy)-3-(2-pyridinyl)-
- IUPAC
- 6-iodo-2-[(4-methylphenyl)methoxy]-3-pyridin-2-ylquinazolin-4-one
Names & synonyms
85178-77-44(3H)-Quinazolinone, 6-iodo-2-((4-methylphenyl)methoxy)-3-(2-pyridinyl)-6-Iodo-2-((4-methylphenyl)methoxy)-3-(2-pyridinyl)-4(3H)-quinazolinoneDTXSID30234356RefChem:284302DTXCID301568476-Iodo-2-[(4-methylphenyl)methoxy]-3-(pyridin-2-yl)quinazolin-4(3H)-one
Database identifiers
- CAS
85178-77-4- PubChem CID
- 63298
- DTXSID
DTXSID30234356
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 54.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 562
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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