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2-[N-(4-bromophenyl)methanesulfonamido]-N-[3-(methylsulfanyl)phenyl]acetamide

2-[N-(4-bromophenyl)methanesulfonamido]-N-[3-(methylsulfanyl)phenyl]acetamide

Formula: C16H17BrN2O3S2

SMILES: CSC1=CC=CC(NC(=O)CN(C2=CC=C(Br)C=C2)S(C)(=O)=O)=C1

IUPAC: 2-[N-(4-bromophenyl)methanesulfonamido]-N-[3-(methylsulfanyl)phenyl]acetamide

InChI: InChI=1S/C16H17BrN2O3S2/c1-23-15-5-3-4-13(10-15)18-16(20)11-19(24(2,21)22)14-8-6-12(17)7-9-14/h3-10H,11H2,1-2H3,(H,18,20)

Composition: C (44.76%), H (3.99%), Br (18.61%), N (6.52%), O (11.18%), S (14.93%)

Molar Mass: 429.35

Atom Count: 41

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 427.986398
Formal Charge 0
FSP3 0.19
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey IIKABPLUWXXTEB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 102.38
Topological Polar Surface Area 66.48
Polarizability 39.65
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H17BrN2O3S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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