4-(2,4-Dimethyl-1-imidazolyl)-3-fluoroaniline - CAS 1235492-75-7
Catalog: |
BB005719 |
Product Name: |
4-(2,4-Dimethyl-1-imidazolyl)-3-fluoroaniline |
CAS: |
1235492-75-7 |
Synonyms: |
4-(2,4-dimethyl-1-imidazolyl)-3-fluoroaniline; 4-(2,4-dimethylimidazol-1-yl)-3-fluoroaniline |
IUPAC Name: | 4-(2,4-dimethylimidazol-1-yl)-3-fluoroaniline |
Description: | 4-(2,4-Dimethyl-1-imidazolyl)-3-fluoroaniline (CAS# 1235492-75-7 ) is a useful research chemical. |
Molecular Weight: | 205.23 |
Molecular Formula: | C11H12FN3 |
Canonical SMILES: | CC1=CN(C(=N1)C)C2=C(C=C(C=C2)N)F |
InChI: | InChI=1S/C11H12FN3/c1-7-6-15(8(2)14-7)11-4-3-9(13)5-10(11)12/h3-6H,13H2,1-2H3 |
InChI Key: | NODRTLLNLVEDFK-UHFFFAOYSA-N |
LogP: | 2.79160 |
Publication Number | Title | Priority Date |
WO-2013059666-A1 | Compounds that modulate intracellular calcium | 20111019 |
EP-2379553-B1 | Bicyclic compounds for the reduction of beta-amyloid production | 20090116 |
ES-2426023-T3 | Bicyclic compounds for the reduction of beta amyloid production | 20090116 |
JP-2012515205-A | Bicyclic compounds for reduction of beta-amyloid production | 20090116 |
JP-5638007-B2 | Bicyclic compounds for reduction of beta-amyloid production | 20090116 |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.10152556 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.10152556 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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