Methyl (R)-2-[1-[(2-Amino-5-bromo-3-pyridyl)oxy]ethyl]-4-fluorobenzoate - CAS 1454848-00-0
Catalog: |
BB009958 |
Product Name: |
Methyl (R)-2-[1-[(2-Amino-5-bromo-3-pyridyl)oxy]ethyl]-4-fluorobenzoate |
CAS: |
1454848-00-0 |
Synonyms: |
2-[1-[(2-amino-5-bromo-3-pyridinyl)oxy]ethyl]-4-fluorobenzoic acid methyl ester; methyl 2-[1-(2-amino-5-bromopyridin-3-yl)oxyethyl]-4-fluorobenzoate |
IUPAC Name: | methyl 2-[(1R)-1-(2-amino-5-bromopyridin-3-yl)oxyethyl]-4-fluorobenzoate |
Description: | Methyl (R)-2-[1-[(2-Amino-5-bromo-3-pyridyl)oxy]ethyl]-4-fluorobenzoate (CAS# 1454848-00-0 ) is a useful research chemical. |
Molecular Weight: | 369.19 |
Molecular Formula: | C15H14BrFN2O3 |
Canonical SMILES: | CC(C1=C(C=CC(=C1)F)C(=O)OC)OC2=CC(=CN=C2N)Br |
InChI: | InChI=1S/C15H14BrFN2O3/c1-8(22-13-5-9(16)7-19-14(13)18)12-6-10(17)3-4-11(12)15(20)21-2/h3-8H,1-2H3,(H2,18,19) |
InChI Key: | NEXBDDSPNVIGGI-UHFFFAOYSA-N |
LogP: | 4.07320 |
Publication Number | Title | Priority Date |
CN-111362967-A | Benzoxadiazatetetradecene derivatives and use thereof | 20200428 |
CN-111362967-B | Benzoxadiazatetetradecene derivatives and use thereof | 20200428 |
CN-112812128-A | Macrocyclic compounds as ALK and ROS modulators | 20191118 |
WO-2018137679-A1 | Process for the Preparation of (10R) -7- (2-aminoacetyl) amino-12-fluoro-2, 10, 16-trimethyl-15-oxo-10, 15, 16, 17-tetrahydro-2H-8, 4- (metheno) pyrazolo [4, 3-h] [2, 5, 11] -benzoxadiazacyclotetradecine-3-carbonitrile | 20170125 |
EP-3013835-B1 | Solid forms of a macrocyclic kinase inhibitor | 20130628 |
Complexity: | 388 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 368.01718 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 368.01718 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 74.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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