Basic information
- CAS
384353-06-4- Standard SMILES
CCOc1ccc(C2=NN3C(C2)c2ccccc2OC3c2ccc(Cl)cc2)cc1- InChIKey
QCHHYMALLMRIRG-UHFFFAOYSA-N- Molecular formula
- C24H21ClN2O2
- Average molar mass
- 404.9 g/mol
- Monoisotopic mass
- 404.1291556
Names & identifiers
- Preferred name
- 5-(4-Chlorophenyl)-2-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
- IUPAC
- 5-(4-chlorophenyl)-2-(4-ethoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
- English name
- 4-[5-(4-chlorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-2-yl]phenyl ethyl ether
- Molecular formula
- C24H21ClN2O2
- Molecular weight
- 404.89
Names & synonyms
384353-06-45-(4-chlorophenyl)-2-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine4-[5-(4-chlorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-2-yl]phenyl ethyl ether5-(4-chlorophenyl)-2-(4-ethoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazineSTK867451AKOS001696845AKOS016245392ST50079242AP-845/417798395-(4-CHLORO-PH)-2-(4-ETHOXYPHENYL)-1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZINE5-(4-chlorophenyl)-2-(4-ethoxyphenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine1-[6-(4-chlorophenyl)(6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazin-9-yl)]-4-e thoxybenzene
Show more names
5H-Pyrazolo[1,5-c][1,3]benzoxazine, 5-(4-chlorophenyl)-2-(4-ethoxyphenyl)-1,10b-dihydro-
5-(4-chlorophenyl)-2-(4-ethoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 583
Physicochemical properties
- Boiling point
- 551 · 551.0±60.0 °C(Predicted)
- Density
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- pka
- 4.36 · 4.36±0.40(Predicted)
Chemistry & industry
Suppliers4 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
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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