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2-(N-benzyl-2,5-dichlorobenzenesulfonamido)-N-(4-iodophenyl)acetamide

2-(N-benzyl-2,5-dichlorobenzenesulfonamido)-N-(4-iodophenyl)acetamide

Formula: C21H17Cl2IN2O3S

SMILES: ClC1=CC=C(Cl)C(=C1)S(=O)(=O)N(CC(=O)NC1=CC=C(I)C=C1)CC1=CC=CC=C1

IUPAC: 2-(N-benzyl-2,5-dichlorobenzenesulfonamido)-N-(4-iodophenyl)acetamide

InChI: InChI=1S/C21H17Cl2IN2O3S/c22-16-6-11-19(23)20(12-16)30(28,29)26(13-15-4-2-1-3-5-15)14-21(27)25-18-9-7-17(24)8-10-18/h1-12H,13-14H2,(H,25,27)

Composition: C (43.85%), H (2.98%), Cl (12.33%), I (22.06%), N (4.87%), O (8.34%), S (5.57%)

Molar Mass: 575.24

Atom Count: 47

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 573.93816
Formal Charge 0
FSP3 0.1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey RUGOXJGOBAFSJG-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 129.96
Topological Polar Surface Area 66.48
Polarizability 50.46
Ring Count 3
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H17Cl2IN2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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