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N-(2,3-dichlorophenyl)-N-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)methanesulfonamide

N-(2,3-dichlorophenyl)-N-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)methanesulfonamide

Formula: C22H25Cl2N3O3S

SMILES: CS(=O)(=O)N(CC(=O)N1CCN(CC=CC2=CC=CC=C2)CC1)C1=CC=CC(Cl)=C1Cl

IUPAC: N-(2,3-dichlorophenyl)-N-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)methanesulfonamide

InChI: InChI=1S/C22H25Cl2N3O3S/c1-31(29,30)27(20-11-5-10-19(23)22(20)24)17-21(28)26-15-13-25(14-16-26)12-6-9-18-7-3-2-4-8-18/h2-11H,12-17H2,1H3/b9-6+

Composition: C (54.77%), H (5.22%), Cl (14.70%), N (8.71%), O (9.95%), S (6.65%)

Molar Mass: 482.42

Atom Count: 56

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 481.0993683
Formal Charge 0
FSP3 0.32
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey GVDSRTJKRLZKTM-RMKNXTFCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 125.93
Topological Polar Surface Area 60.93
Polarizability 49.21
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 C22H25Cl2N3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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