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N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(2,5-dimethoxyphenyl)-4-methylbenzenesulfonamido]acetamide

N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(2,5-dimethoxyphenyl)-4-methylbenzenesulfonamido]acetamide

Formula: C23H32N2O5S2

SMILES: COC1=CC=C(OC)C(=C1)N(CC(=O)NCCSC(C)(C)C)S(=O)(=O)C1=CC=C(C)C=C1

IUPAC: N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(2,5-dimethoxyphenyl)-4-methylbenzenesulfonamido]acetamide

InChI: InChI=1S/C23H32N2O5S2/c1-17-7-10-19(11-8-17)32(27,28)25(16-22(26)24-13-14-31-23(2,3)4)20-15-18(29-5)9-12-21(20)30-6/h7-12,15H,13-14,16H2,1-6H3,(H,24,26)

Composition: C (57.48%), H (6.71%), N (5.83%), O (16.64%), S (13.34%)

Molar Mass: 480.64

Atom Count: 64

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 480.175264486
Formal Charge 0
FSP3 0.43
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey DAFUFYKOEUOERG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 129.64
Topological Polar Surface Area 84.94
Polarizability 51.01
Ring Count 2
Rotatable Bond Count 10

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H32N2O5S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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