6-Chloro-3-(2-chloro-6-nitrobenzyl)-4(3H)-quinazolinone
Basic information
- CAS
892156-84-2- Standard SMILES
O=c1c2cc(Cl)ccc2ncn1Cc1c(Cl)cccc1[N+](=O)[O-]- InChIKey
IAINZJLXNRXONV-UHFFFAOYSA-N- Molecular formula
- C15H9Cl2N3O3
- Average molar mass
- 350.2 g/mol
- Monoisotopic mass
- 349.0020965
Names & identifiers
- Preferred name
- 6-Chloro-3-(2-chloro-6-nitrobenzyl)-4(3H)-quinazolinone
- IUPAC
- 6-chloro-3-[(2-chloro-6-nitrophenyl)methyl]quinazolin-4-one
Names & synonyms
AKOS0244089056-CHLORO-3-(2-CHLORO-6-NITROBENZYL)-4(3H)-QUINAZOLINONE
Database identifiers
- CAS
892156-84-2- PubChem CID
- 4425399
- EC Number
- 126-811-0
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 511
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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