4(3H)-Quinazolinone, 3-(2-(2,5-dihydroxyphenyl)ethyl)-8-iodo-2-(2-phenylethenyl)-
Basic information
- CAS
86804-57-1- Standard SMILES
O=c1c2cccc(I)c2nc(/C=C/c2ccccc2)n1CCc1cc(O)ccc1O- InChIKey
RUWMANAANHONOP-FMIVXFBMSA-N- Molecular formula
- C24H19IN2O3
- Average molar mass
- 510.3 g/mol
- Monoisotopic mass
- 510.04404
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(2-(2,5-dihydroxyphenyl)ethyl)-8-iodo-2-(2-phenylethenyl)-
- IUPAC
- 3-[2-(2,5-dihydroxyphenyl)ethyl]-8-iodo-2-[(E)-2-phenylethenyl]quinazolin-4-one
Names & synonyms
4(3H)-Quinazolinone, 3-(2-(2,5-dihydroxyphenyl)ethyl)-8-iodo-2-(2-phenylethenyl)-86804-57-1RefChem:10691243-(2-(2,5-Dihydroxyphenyl)ethyl)-8-iodo-2-(2-phenylethenyl)-4(3H)-quinazolinone
Database identifiers
- CAS
86804-57-1- PubChem CID
- 6435982
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 661
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…