Basic information
- CAS
332060-52-3- Standard SMILES
O=C(c1ccc(Br)cc1)C1Oc2ccc(Cl)cc2C2CC(c3ccc(Cl)cc3)=NN12- InChIKey
KYLOELNIBPDZSQ-UHFFFAOYSA-N- Molecular formula
- C23H15BrCl2N2O2
- Average molar mass
- 502.2 g/mol
- Monoisotopic mass
- 499.9694
Names & identifiers
- Preferred name
- (4-Bromophenyl)[9-chloro-2-(4-chlorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]methanone
- IUPAC
- (4-bromophenyl)-[9-chloro-2-(4-chlorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]methanone
- English name
- (4-bromophenyl)[9-chloro-2-(4-chlorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]methanone
- Molecular formula
- C23H15BrCl2N2O2
- Molecular weight
- 502.1874
Names & synonyms
(4-bromophenyl)[9-chloro-2-(4-chlorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]methanoneOprea1_291119Oprea1_733835AKOS024424434(4-bromophenyl)-[9-chloro-2-(4-chlorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]methanoneAG-690/12409312
Database identifiers
- CAS
332060-52-3- PubChem CID
- 3121744
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 676
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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