Home Sulfos N-{2-[4-(but-2-yn-1-yloxy)benzenesulfonyl]-1-[4-(methanesulfonamidomethyl)phenyl]ethyl}-N-hydroxyformamide

N-{2-[4-(but-2-yn-1-yloxy)benzenesulfonyl]-1-[4-(methanesulfonamidomethyl)phenyl]ethyl}-N-hydroxyformamide

CAS No.:
1365803-52-6
Catalog Number:
AG01EIP1
Molecular Formula:
C21H24N2O7S2
Molecular Weight:
480.5545
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Product Description
Catalog Number:
AG01EIP1
Chemical Name:
N-{2-[4-(but-2-yn-1-yloxy)benzenesulfonyl]-1-[4-(methanesulfonamidomethyl)phenyl]ethyl}-N-hydroxyformamide
CAS Number:
1365803-52-6
Molecular Formula:
C21H24N2O7S2
Molecular Weight:
480.5545
MDL Number:
MFCD31736385
IUPAC Name:
N-[2-(4-but-2-ynoxyphenyl)sulfonyl-1-[4-(methanesulfonamidomethyl)phenyl]ethyl]-N-hydroxyformamide
InChI:
InChI=1S/C21H24N2O7S2/c1-3-4-13-30-19-9-11-20(12-10-19)32(28,29)15-21(23(25)16-24)18-7-5-17(6-8-18)14-22-31(2,26)27/h5-12,16,21-22,25H,13-15H2,1-2H3
InChI Key:
VIWDSTUVCAZZDF-UHFFFAOYSA-N
SMILES:
O=CN(C(c1ccc(cc1)CNS(=O)(=O)C)CS(=O)(=O)c1ccc(cc1)OCC#CC)O
Properties
Complexity:
865  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
480.102g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
480.55g/mol
Monoisotopic Mass:
480.102g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
147A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties