Home Sulfos Bis-sulfone-peg4-dbco

Bis-sulfone-peg4-dbco

CAS No.:
1854034-70-0
Catalog Number:
AG00I1JV
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00I1JV
Chemical Name:
Bis-sulfone-peg4-dbco
CAS Number:
1854034-70-0
MDL Number:
MFCD28505546
IUPAC Name:
N-[2-[2-[2-[2-[3-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]-4-[3-(4-methylphenyl)sulfonyl-2-[(4-methylphenyl)sulfonylmethyl]propanoyl]benzamide
InChI:
InChI=1S/C54H59N3O12S2/c1-40-11-21-48(22-12-40)70(62,63)38-47(39-71(64,65)49-23-13-41(2)14-24-49)53(60)44-17-19-45(20-18-44)54(61)56-28-30-67-32-34-69-36-35-68-33-31-66-29-26-51(58)55-27-25-52(59)57-37-46-9-4-3-7-42(46)15-16-43-8-5-6-10-50(43)57/h3-14,17-24,47H,25-39H2,1-2H3,(H,55,58)(H,56,61)
InChI Key:
ADIRLUISORIXON-UHFFFAOYSA-N
Properties
Complexity:
1910  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1005.354g/mol
Formal Charge:
0
Heavy Atom Count:
71  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
1006.195g/mol
Monoisotopic Mass:
1005.354g/mol
Rotatable Bond Count:
27  
Topological Polar Surface Area:
218A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties