Methyl (R)-2-[1-[(2-Amino-3-pyridyl)oxy]ethyl]-4-fluorobenzoate - CAS 1454847-99-4
Catalog: |
BB009956 |
Product Name: |
Methyl (R)-2-[1-[(2-Amino-3-pyridyl)oxy]ethyl]-4-fluorobenzoate |
CAS: |
1454847-99-4 |
Synonyms: |
2-[1-[(2-amino-3-pyridinyl)oxy]ethyl]-4-fluorobenzoic acid methyl ester; methyl 2-[1-(2-aminopyridin-3-yl)oxyethyl]-4-fluorobenzoate |
IUPAC Name: | methyl 2-[(1R)-1-(2-aminopyridin-3-yl)oxyethyl]-4-fluorobenzoate |
Description: | Methyl (R)-2-[1-[(2-Amino-3-pyridyl)oxy]ethyl]-4-fluorobenzoate (CAS# 1454847-99-4 ) is a useful research chemical. |
Molecular Weight: | 290.29 |
Molecular Formula: | C15H15FN2O3 |
Canonical SMILES: | CC(C1=C(C=CC(=C1)F)C(=O)OC)OC2=C(N=CC=C2)N |
InChI: | InChI=1S/C15H15FN2O3/c1-9(21-13-4-3-7-18-14(13)17)12-8-10(16)5-6-11(12)15(19)20-2/h3-9H,1-2H3,(H2,17,18) |
InChI Key: | GMFQSQNAGPWXPZ-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
CN-112812128-A | Macrocyclic compounds as ALK and ROS modulators | 20191118 |
US-2016115178-A1 | Solid forms of a macrocyclic kinase inhibitor | 20130628 |
US-9637500-B2 | Solid forms of a macrocyclic kinase inhibitor | 20130628 |
WO-2014207606-A1 | Solid forms of a macrocyclic kinase inhibitor | 20130628 |
EP-2822953-B1 | Macrocyclic derivatives for the treatment of proliferative diseases | 20120306 |
Complexity: | 356 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 290.10667051 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 290.10667051 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 74.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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