Home Sulfos (R)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(2-chloroformylpyrrolidin-1-yl)-2,1,3-benzoxadiazole

(R)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(2-chloroformylpyrrolidin-1-yl)-2,1,3-benzoxadiazole

CAS No.:
150993-62-7
Catalog Number:
AG001MYV
Molecular Formula:
C13H15ClN4O4S
Molecular Weight:
358.8006
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
>95.0%(HPLC)
1 week
United States
$382
- +
Product Description
Catalog Number:
AG001MYV
Chemical Name:
(R)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(2-chloroformylpyrrolidin-1-yl)-2,1,3-benzoxadiazole
CAS Number:
150993-62-7
Molecular Formula:
C13H15ClN4O4S
Molecular Weight:
358.8006
MDL Number:
MFCD00221513
IUPAC Name:
(2R)-1-[4-(dimethylsulfamoyl)-2,1,3-benzoxadiazol-7-yl]pyrrolidine-2-carbonyl chloride
InChI:
InChI=1S/C13H15ClN4O4S/c1-17(2)23(20,21)10-6-5-8(11-12(10)16-22-15-11)18-7-3-4-9(18)13(14)19/h5-6,9H,3-4,7H2,1-2H3/t9-/m1/s1
InChI Key:
ZPBKQTOHYMFDLD-SECBINFHSA-N
SMILES:
ClC(=O)[C@H]1CCCN1c1ccc(c2c1non2)S(=O)(=O)N(C)C
Properties
Complexity:
567  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
358.05g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.797g/mol
Monoisotopic Mass:
358.05g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties