Basic information
- CAS
332063-07-7- Standard SMILES
Clc1ccc(C2Oc3ccc(Br)cc3C3CC(c4cccs4)=NN32)cc1- InChIKey
VQDJVPLDKUHNOL-UHFFFAOYSA-N- Molecular formula
- C20H14BrClN2OS
- Average molar mass
- 445.8 g/mol
- Monoisotopic mass
- 443.96987
Names & identifiers
- Preferred name
- 9-Bromo-5-(4-chlorophenyl)-2-thien-2-yl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
- IUPAC
- 9-bromo-5-(4-chlorophenyl)-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
- English name
- 9-bromo-5-(4-chlorophenyl)-2-thien-2-yl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
- Molecular formula
- C20H14BrClN2OS
- Molecular weight
- 445.75996
Names & synonyms
9-bromo-5-(4-chlorophenyl)-2-thien-2-yl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazineChemDiv1_008707HMS611L17AKOS001641937AKOS0219989639-bromo-5-(4-chlorophenyl)-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazineAG-690/12409432SR-01000475304SR-01000475304-18-BR-4(4-CL-PH)2-THIOPHEN-2-YL-1,9B-2H-5-OXA-3,3A-DIAZA-CYCLOPENTA(A)NAPHTHALENE9-bromo-5-(4-chlorophenyl)-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Database identifiers
- CAS
332063-07-7- PubChem CID
- 4464879
- EC Number
- 160-206-2
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 556
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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