5-Bromo-2-chloro-4-(trifluoromethyl)pyrimidine - CAS 785777-92-6
Catalog: |
BB036193 |
Product Name: |
5-Bromo-2-chloro-4-(trifluoromethyl)pyrimidine |
CAS: |
785777-92-6 |
Synonyms: |
5-bromo-2-chloro-4-(trifluoromethyl)pyrimidine; 5-bromo-2-chloro-4-(trifluoromethyl)pyrimidine |
IUPAC Name: | 5-bromo-2-chloro-4-(trifluoromethyl)pyrimidine |
Description: | 5-Bromo-2-chloro-4-(trifluoromethyl)pyrimidine (CAS# 785777-92-6) is a useful research chemical. |
Molecular Weight: | 261.43 |
Molecular Formula: | C5HBrClF3N2 |
Canonical SMILES: | C1=C(C(=NC(=N1)Cl)C(F)(F)F)Br |
InChI: | InChI=1S/C5HBrClF3N2/c6-2-1-11-4(7)12-3(2)5(8,9)10/h1H |
InChI Key: | VTIPESROQQNDJL-UHFFFAOYSA-N |
LogP: | 2.91130 |
Publication Number | Title | Priority Date |
AU-2017255525-A1 | 6-aminopyridin-3-yl thiazoles as modulators of rorgammat | 20160427 |
CA-3022318-A1 | 6-aminopyridin-3-yl thiazoles as modulators of ror.gamma.t | 20160427 |
EP-3448856-A1 | 6-aminopyridin-3-yl thiazoles as modulators of ror t | 20160427 |
JP-2019515924-A | 6-Aminopyridin-3-ylthiazole as a modulator of RORγt | 20160427 |
TW-201803869-A | 6-aminopyridin-3-ylthiazole as a RORγT modulator | 20160427 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.89637 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.89637 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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