5-Cyclopropyl-3-(3,5-dichloro-4-pyridyl)isoxazole-4-methanol - CAS 1020570-04-0
Catalog: |
BB000764 |
Product Name: |
5-Cyclopropyl-3-(3,5-dichloro-4-pyridyl)isoxazole-4-methanol |
CAS: |
1020570-04-0 |
Synonyms: |
[5-cyclopropyl-3-(3,5-dichloro-4-pyridinyl)-4-isoxazolyl]methanol; [5-cyclopropyl-3-(3,5-dichloropyridin-4-yl)-1,2-oxazol-4-yl]methanol |
IUPAC Name: | [5-cyclopropyl-3-(3,5-dichloropyridin-4-yl)-1,2-oxazol-4-yl]methanol |
Description: | 5-Cyclopropyl-3-(3,5-dichloro-4-pyridyl)isoxazole-4-methanol (CAS# 1020570-04-0 ) is a useful research chemical. |
Molecular Weight: | 285.13 |
Molecular Formula: | C12H10Cl2N2O2 |
Canonical SMILES: | C1CC1C2=C(C(=NO2)C3=C(C=NC=C3Cl)Cl)CO |
InChI: | InChI=1S/C12H10Cl2N2O2/c13-8-3-15-4-9(14)10(8)11-7(5-17)12(18-16-11)6-1-2-6/h3-4,6,17H,1-2,5H2 |
InChI Key: | CPJZYYFKLNQGQU-UHFFFAOYSA-N |
LogP: | 3.41310 |
Publication Number | Title | Priority Date |
AU-2018360575-A1 | Alkene spirocyclic compounds as farnesoid X receptor modulators | 20171101 |
AU-2018360577-A1 | Bridged bicyclic compounds as farnesoid X receptor modulators | 20171101 |
CN-111295382-A | Bridged bicyclic compounds as modulators of farnesoid X receptors | 20171101 |
US-2019127358-A1 | Bridged bicyclic compounds as farnesoid x receptor modulators | 20171101 |
WO-2019089665-A1 | Alkene spirocyclic compounds as farnesoid x receptor modulators | 20171101 |
Complexity: | 294 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 284.011933 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 284.011933 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 59.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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