Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(C=Cc2nc(Cl)c3ccccc3n2)o1- InChIKey
ABLXAMAOLHNSPA-UHFFFAOYSA-N- Molecular formula
- C14H8ClN3O3
- Average molar mass
- 301.68 g/mol
- Monoisotopic mass
- 301.0254188
Names & identifiers
- Preferred name
- 2-[2-(5-Nitro-2-furyl)vinyl]-4-chloroquinazoline
- IUPAC
- 4-chloro-2-[2-(5-nitrofuran-2-yl)ethenyl]quinazoline
Names & synonyms
SCHEMBL3993957ABLXAMAOLHNSPA-UHFFFAOYSA-N2-[2-(5-nitro-2-furyl)vinyl]-4-chloroquinazoline
Database identifiers
- PubChem CID
- 53634079
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 415
Related reactions
12 records
Compound notes
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