5-Cyclopropyl-3-[2-(trifluoromethoxy)phenyl]isoxazole-4-methanol - CAS 946426-90-0
Catalog: |
BB041441 |
Product Name: |
5-Cyclopropyl-3-[2-(trifluoromethoxy)phenyl]isoxazole-4-methanol |
CAS: |
946426-90-0 |
Synonyms: |
[5-cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-4-isoxazolyl]methanol; [5-cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-1,2-oxazol-4-yl]methanol |
IUPAC Name: | [5-cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-1,2-oxazol-4-yl]methanol |
Description: | 5-Cyclopropyl-3-[2-(trifluoromethoxy)phenyl]isoxazole-4-methanol (CAS# 946426-90-0 ) is a useful research chemical. |
Molecular Weight: | 299.25 |
Molecular Formula: | C14H12F3NO3 |
Canonical SMILES: | C1CC1C2=C(C(=NO2)C3=CC=CC=C3OC(F)(F)F)CO |
InChI: | InChI=1S/C14H12F3NO3/c15-14(16,17)20-11-4-2-1-3-9(11)12-10(7-19)13(21-18-12)8-5-6-8/h1-4,8,19H,5-7H2 |
InChI Key: | YJPRZVHHSVCUIU-UHFFFAOYSA-N |
LogP: | 3.60990 |
Publication Number | Title | Priority Date |
WO-2021161216-A1 | Farnesoid x receptor modulating compounds and methods of using the same | 20200211 |
CN-112812114-A | Isoxazole derivative, pharmaceutical composition containing isoxazole derivative, and preparation method and application of isoxazole derivative | 20191115 |
WO-2020234726-A1 | Combinations comprising benzodioxol as glp-1r agonists for use in the treatment of nash/nafld and related diseases | 20190520 |
WO-2020114307-A1 | Isoxazole derivative, preparation method therefor and use thereof | 20181207 |
CN-112805279-A | Isoxazole derivative and preparation method and application thereof | 20181207 |
Complexity: | 362 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.07692773 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.07692773 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 55.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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Isoxazoles
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