Basic information
- CAS
54209-48-2- Standard SMILES
CCCCOc1ccc(-n2c(=O)[nH]c3ccccc3c2=O)cc1- InChIKey
DUAJXTNGNHTVGR-UHFFFAOYSA-N- Molecular formula
- C18H18N2O3
- Average molar mass
- 310.3 g/mol
- Monoisotopic mass
- 310.13174244
Names & identifiers
- Preferred name
- 3-(4-butoxyphenyl)-1H-quinazoline-2,4-dione
- IUPAC
- 3-(4-butoxyphenyl)-1H-quinazoline-2,4-dione
Names & synonyms
NSC33885054209-48-2DTXSID60319044NSC-338850DS-0035523-(4-Butoxyphenyl)quinazoline-2,4(1H,3H)-dione2,4(1H,3h)-quinazolinedione,3-(4-butoxyphenyl)-
Database identifiers
- CAS
54209-48-2- PubChem CID
- 334283
- DTXSID
DTXSID60319044
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 432
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…