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ethyl 4-[2-(N-benzyl-2,5-dichlorobenzenesulfonamido)acetamido]benzoate

ethyl 4-[2-(N-benzyl-2,5-dichlorobenzenesulfonamido)acetamido]benzoate

Formula: C24H22Cl2N2O5S

SMILES: CCOC(=O)C1=CC=C(NC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C2=CC(Cl)=CC=C2Cl)C=C1

IUPAC: ethyl 4-[2-(N-benzyl-2,5-dichlorobenzenesulfonamido)acetamido]benzoate

InChI: InChI=1S/C24H22Cl2N2O5S/c1-2-33-24(30)18-8-11-20(12-9-18)27-23(29)16-28(15-17-6-4-3-5-7-17)34(31,32)22-14-19(25)10-13-21(22)26/h3-14H,2,15-16H2,1H3,(H,27,29)

Composition: C (55.29%), H (4.25%), Cl (13.60%), N (5.37%), O (15.34%), S (6.15%)

Molar Mass: 521.41

Atom Count: 56

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 520.0626484
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey WZACBVISHHKEPU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 133.37
Topological Polar Surface Area 92.78
Polarizability 51.61
Ring Count 3
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H22Cl2N2O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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