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2-chloro-5-({[(3-chlorophenyl)formamido]methanethioyl}amino)benzoic acid

2-chloro-5-({[(3-chlorophenyl)formamido]methanethioyl}amino)benzoic acid

Formula: C15H10Cl2N2O3S

SMILES: OC(=O)C1=CC(NC(=S)NC(=O)C2=CC=CC(Cl)=C2)=CC=C1Cl

IUPAC: 2-chloro-5-({[(3-chlorophenyl)formamido]methanethioyl}amino)benzoic acid

InChI: InChI=1S/C15H10Cl2N2O3S/c16-9-3-1-2-8(6-9)13(20)19-15(23)18-10-4-5-12(17)11(7-10)14(21)22/h1-7H,(H,21,22)(H2,18,19,20,23)

Composition: C (48.80%), H (2.73%), Cl (19.20%), N (7.59%), O (13.00%), S (8.68%)

Molar Mass: 369.22

Atom Count: 33

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 367.9789188
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey UZKMUBMNGXLYKX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.69
Topological Polar Surface Area 78.43
Polarizability 35.32
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H10Cl2N2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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