Text Search
Structure Search

N-(5-bromo-6-methylpyridin-3-yl)-2-(trifluoromethyl)pyridine-4-carboxamide

N-(5-bromo-6-methylpyridin-3-yl)-2-(trifluoromethyl)pyridine-4-carboxamide

CAS: 1886972-98-0

Formula: C13H9BrF3N3O

SMILES: CC1=NC=C(NC(=O)C2=CC=NC(=C2)C(F)(F)F)C=C1Br

IUPAC: N-(5-bromo-6-methylpyridin-3-yl)-2-(trifluoromethyl)pyridine-4-carboxamide

InChI: InChI=1S/C13H9BrF3N3O/c1-7-10(14)5-9(6-19-7)20-12(21)8-2-3-18-11(4-8)13(15,16)17/h2-6H,1H3,(H,20,21)

Composition: C (43.36%), H (2.52%), Br (22.19%), F (15.83%), N (11.67%), O (4.44%)

Molar Mass: 360.134

Atom Count: 30

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 358.988109
Formal Charge 0
FSP3 0.15
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey RMFHOBASGLCQMR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.09
Topological Polar Surface Area 54.88
Polarizability 27.17
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
J&W PHARMLAB LLC
Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 1886972-98-0 $572.70-$2,162.00$572.70$1,147.70$2,162.00
Request Quote