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Home Other Building Blocks Sparsentan (RE-021)

Sparsentan (RE-021)

CAS No.:
254740-64-2
Catalog Number:
AG00C2P2
Molecular Formula:
C32H40N4O5S
Molecular Weight:
592.7488
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$265
- +
10mg
99%
1 week
United States
$404
- +
25mg
99%
1 week
United States
$682
- +
50mg
99%
1 week
United States
$1098
- +
100mg
99%
1 week
United States
$1793
- +
Product Description
Catalog Number:
AG00C2P2
Chemical Name:
Sparsentan (RE-021)
CAS Number:
254740-64-2
Molecular Formula:
C32H40N4O5S
Molecular Weight:
592.7488
MDL Number:
MFCD16628036
IUPAC Name:
2-[4-[(2-butyl-4-oxo-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]-2-(ethoxymethyl)phenyl]-N-(4,5-dimethyl-1,2-oxazol-3-yl)benzenesulfonamide
InChI:
InChI=1S/C32H40N4O5S/c1-5-7-14-29-33-32(17-10-11-18-32)31(37)36(29)20-24-15-16-26(25(19-24)21-40-6-2)27-12-8-9-13-28(27)42(38,39)35-30-22(3)23(4)41-34-30/h8-9,12-13,15-16,19H,5-7,10-11,14,17-18,20-21H2,1-4H3,(H,34,35)
InChI Key:
WRFHGDPIDHPWIQ-UHFFFAOYSA-N
SMILES:
CCCCC1=NC2(C(=O)N1Cc1ccc(c(c1)COCC)c1ccccc1S(=O)(=O)Nc1noc(c1C)C)CCCC2
UNII:
9242RO5URM
Properties
Complexity:
1060  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
592.272g/mol
Formal Charge:
0
Heavy Atom Count:
42  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
592.755g/mol
Monoisotopic Mass:
592.272g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Literature
Title Journal
Chemokine receptor antagonists. Journal of medicinal chemistry 20121126
Focal segmental glomerulosclerosis. The New England journal of medicine 20111222
Dual angiotensin II and endothelin A receptor antagonists: synthesis of 2'-substituted N-3-isoxazolyl biphenylsulfonamides with improved potency and pharmacokinetics. Journal of medicinal chemistry 20050113
Properties