6-bromo-3-(5-(2-methoxyphenyl)-4,5-dihydroisoxazol-3-yl)-4-phenylquinolin-2(1H)-one
Basic information
- CAS
6027-54-9- Standard SMILES
COc1ccccc1C1CC(c2c(-c3ccccc3)c3cc(Br)ccc3[nH]c2=O)=NO1- InChIKey
TXKYRFONPYQKPU-UHFFFAOYSA-N- Molecular formula
- C25H19BrN2O3
- Average molar mass
- 475.3 g/mol
- Monoisotopic mass
- 474.05791
Names & identifiers
- Preferred name
- 6-bromo-3-(5-(2-methoxyphenyl)-4,5-dihydroisoxazol-3-yl)-4-phenylquinolin-2(1H)-one
- IUPAC
- 6-bromo-3-[5-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]-4-phenyl-1H-quinolin-2-one
Names & synonyms
143584-96-76-bromo-3-(5-(2-methoxyphenyl)-4,5-dihydroisoxazol-3-yl)-4-phenylquinolin-2(1H)-one6027-54-96-bromo-3-[5-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-oneBAS 00434218CBMicro_004199DTXSID804173396-bromo-3-[5-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]-4-phenylquinolin-2(1H)-oneSMSF0011568STK857366STL046511AKOS000639011
Show more names
AKOS005699806AKOS021994954CB06061BIM-0004334.P001ST50229395Z57111128F0122-00026-bromo-3-[5-(2-methoxyphenyl)(4,5-dihydroisoxazol-3-yl)]-4-phenylhydroquinoli n-2-one
Database identifiers
- CAS
6027-54-9- PubChem CID
- 2880933
- DTXSID
DTXSID80417339
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 59.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 745
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