Basic information
- CAS
144485-80-3- Standard SMILES
CCc1nc2cc(Cl)ccc2c(=O)n1-c1cc(C)no1- InChIKey
NJTVXZZJDSMNBU-UHFFFAOYSA-N- Molecular formula
- C14H12ClN3O2
- Average molar mass
- 289.71 g/mol
- Monoisotopic mass
- 289.0618043
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 7-chloro-2-ethyl-3-(3-methyl-5-isoxazolyl)-
- IUPAC
- 7-chloro-2-ethyl-3-(3-methyl-1,2-oxazol-5-yl)quinazolin-4-one
Names & synonyms
BRN 53500694(3H)-Quinazolinone, 7-chloro-2-ethyl-3-(3-methyl-5-isoxazolyl)-144485-80-37-Chloro-2-ethyl-3-(3-methyl-5-isoxazolyl)-4(3H)-quinazolinoneDTXSID80162716RefChem:284326DTXCID90852077-chloro-2-ethyl-3-(3-methyl-1,2-oxazol-5-yl)quinazolin-4(3h)-one
Database identifiers
- CAS
144485-80-3- PubChem CID
- 64010
- DTXSID
DTXSID80162716- Nikkaji
- J481.108I
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 429
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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