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N-(3-{2-[(4-chlorophenyl)sulfanyl]acetamido}phenyl)thiophene-2-carboxamide

N-(3-{2-[(4-chlorophenyl)sulfanyl]acetamido}phenyl)thiophene-2-carboxamide

Formula: C19H15ClN2O2S2

SMILES: ClC1=CC=C(SCC(=O)NC2=CC=CC(NC(=O)C3=CC=CS3)=C2)C=C1

IUPAC: N-(3-{2-[(4-chlorophenyl)sulfanyl]acetamido}phenyl)thiophene-2-carboxamide

InChI: InChI=1S/C19H15ClN2O2S2/c20-13-6-8-16(9-7-13)26-12-18(23)21-14-3-1-4-15(11-14)22-19(24)17-5-2-10-25-17/h1-11H,12H2,(H,21,23)(H,22,24)

Composition: C (56.64%), H (3.75%), Cl (8.80%), N (6.95%), O (7.94%), S (15.91%)

Molar Mass: 402.91

Atom Count: 41

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 402.0263478
Formal Charge 0
FSP3 0.05
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey WCHPYALTHNXRKW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.55
Topological Polar Surface Area 58.2
Polarizability 41.01
Ring Count 3
Rotatable Bond Count 6

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H15ClN2O2S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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