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N-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-thiazol-2-yl}acetamide

N-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-thiazol-2-yl}acetamide

CAS: 2058813-42-4

Formula: C11H7ClF3N3OS

SMILES: CC(=O)NC1=NC(=CS1)C1=C(Cl)C=C(C=N1)C(F)(F)F

IUPAC: N-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-thiazol-2-yl}acetamide

InChI: InChI=1S/C11H7ClF3N3OS/c1-5(19)17-10-18-8(4-20-10)9-7(12)2-6(3-16-9)11(13,14)15/h2-4H,1H3,(H,17,18,19)

Composition: C (41.07%), H (2.19%), Cl (11.02%), F (17.72%), N (13.06%), O (4.97%), S (9.97%)

Molar Mass: 321.7

Atom Count: 27

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 320.9950452
Formal Charge 0
FSP3 0.18
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey PSPYSBGQCKGFRX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.62
Topological Polar Surface Area 54.88
Polarizability 26.27
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 2058813-42-4 $51.35-$86.31$51.35$63.37$86.31
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