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3-chloro-N-(5-chlorothiophen-2-ylsulfonyl)-5-(trifluoromethyl)pyridine-2-carboximidamide

3-chloro-N-(5-chlorothiophen-2-ylsulfonyl)-5-(trifluoromethyl)pyridine-2-carboximidamide

CAS: 2085690-38-4

Formula: C11H6Cl2F3N3O2S2

SMILES: FC(F)(F)C1=CC(Cl)=C(N=C1)C(=N)NS(=O)(=O)C1=CC=C(Cl)S1

IUPAC: 3-chloro-N-[(5-chlorothiophen-2-yl)sulfonyl]-5-(trifluoromethyl)pyridine-2-carboximidamide

InChI: InChI=1S/C11H6Cl2F3N3O2S2/c12-6-3-5(11(14,15)16)4-18-9(6)10(17)19-23(20,21)8-2-1-7(13)22-8/h1-4H,(H2,17,19)

Composition: C (32.69%), H (1.50%), Cl (17.54%), F (14.10%), N (10.40%), O (7.92%), S (15.86%)

Molar Mass: 404.2

Atom Count: 29

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 402.9230587
Formal Charge 0
FSP3 0.09
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey PKIJHVFMUZVTPE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.4
Topological Polar Surface Area 82.91
Polarizability 31.03
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 2085690-38-4 $51.35-$86.31$51.35$63.37$86.31
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