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3-chloro-N-{4'-chloro-[1,1'-biphenyl]-4-yl}-1-benzothiophene-2-carboxamide

3-chloro-N-{4'-chloro-[1,1'-biphenyl]-4-yl}-1-benzothiophene-2-carboxamide

Formula: C21H13Cl2NOS

SMILES: ClC1=C(SC2=CC=CC=C12)C(=O)NC1=CC=C(C=C1)C1=CC=C(Cl)C=C1

IUPAC: 3-chloro-N-{4'-chloro-[1,1'-biphenyl]-4-yl}-1-benzothiophene-2-carboxamide

InChI: InChI=1S/C21H13Cl2NOS/c22-15-9-5-13(6-10-15)14-7-11-16(12-8-14)24-21(25)20-19(23)17-3-1-2-4-18(17)26-20/h1-12H,(H,24,25)

Composition: C (63.33%), H (3.29%), Cl (17.80%), N (3.52%), O (4.02%), S (8.05%)

Molar Mass: 398.3

Atom Count: 39

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 397.0094906
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey ZJULLCNRXDRFBZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 109.46
Topological Polar Surface Area 29.1
Polarizability 43.84
Ring Count 4
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H13Cl2NOS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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