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N-[(4-methoxyphenyl)methyl]-2-methyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide

N-[(4-methoxyphenyl)methyl]-2-methyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide

CAS: 338793-11-6

Formula: C14H13F3N2O2S

SMILES: COC1=CC=C(CNC(=O)C2=C(N=C(C)S2)C(F)(F)F)C=C1

IUPAC: N-[(4-methoxyphenyl)methyl]-2-methyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide

InChI: InChI=1S/C14H13F3N2O2S/c1-8-19-12(14(15,16)17)11(22-8)13(20)18-7-9-3-5-10(21-2)6-4-9/h3-6H,7H2,1-2H3,(H,18,20)

Composition: C (50.91%), H (3.97%), F (17.25%), N (8.48%), O (9.69%), S (9.71%)

Molar Mass: 330.33

Atom Count: 35

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 330.06498333
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey IKRZEBNOKVJTQK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.14
Topological Polar Surface Area 51.22
Polarizability 27.96
Ring Count 2
Rotatable Bond Count 5

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90% <2 Days 338793-11-6 $51.35-$86.31$51.35$63.37$86.31
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