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Home Halogens 4-bromo-5-(1-pyrrolidinyl)-3(2H)-pyridazinone

4-bromo-5-(1-pyrrolidinyl)-3(2H)-pyridazinone

CAS No.:
692749-93-2
Catalog Number:
AG00FD97
Molecular Formula:
C8H10BrN3O
Molecular Weight:
244.0885
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG00FD97
Chemical Name:
4-bromo-5-(1-pyrrolidinyl)-3(2H)-pyridazinone
CAS Number:
692749-93-2
Molecular Formula:
C8H10BrN3O
Molecular Weight:
244.0885
MDL Number:
MFCD03617663
IUPAC Name:
5-bromo-4-pyrrolidin-1-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C8H10BrN3O/c9-7-6(5-10-11-8(7)13)12-3-1-2-4-12/h5H,1-4H2,(H,11,13)
InChI Key:
VQDGSEAYARKYIA-UHFFFAOYSA-N
SMILES:
Brc1c(cn[nH]c1=O)N1CCCC1
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.001g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.092g/mol
Monoisotopic Mass:
243.001g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties