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N-(2,3-dichlorophenyl)-2-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide

N-(2,3-dichlorophenyl)-2-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide

Formula: C14H10Cl2F3N3OS

SMILES: CC1=CC(=NC(SCC(=O)NC2=CC=CC(Cl)=C2Cl)=N1)C(F)(F)F

IUPAC: N-(2,3-dichlorophenyl)-2-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide

InChI: InChI=1S/C14H10Cl2F3N3OS/c1-7-5-10(14(17,18)19)22-13(20-7)24-6-11(23)21-9-4-2-3-8(15)12(9)16/h2-5H,6H2,1H3,(H,21,23)

Composition: C (42.44%), H (2.54%), Cl (17.89%), F (14.39%), N (10.61%), O (4.04%), S (8.09%)

Molar Mass: 396.21

Atom Count: 34

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 394.987373
Formal Charge 0
FSP3 0.21
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FSEWSWOVFYEOHF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.74
Topological Polar Surface Area 54.88
Polarizability 32.98
Ring Count 2
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H10Cl2F3N3OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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