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Prinoxodan

CAS No.:
111786-07-3
Catalog Number:
AG009U4V
Molecular Formula:
C13H13N4O2
Molecular Weight:
257.2679
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
95%
1 week
United States
$960
- +
Product Description
Catalog Number:
AG009U4V
Chemical Name:
Prinoxodan
CAS Number:
111786-07-3
Molecular Formula:
C13H13N4O2
Molecular Weight:
257.2679
MDL Number:
MFCD00867136
IUPAC Name:
3-methyl-6-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1,4-dihydroquinazolin-2-one
InChI:
InChI=1S/C13H14N4O2/c1-17-7-9-6-8(2-3-10(9)14-13(17)19)11-4-5-12(18)16-15-11/h2-3,6H,4-5,7H2,1H3,(H,14,19)(H,16,18)
InChI Key:
SUCNEHPNQBBVHQ-UHFFFAOYSA-N
SMILES:
O=C1CCC(=N[N]1)c1ccc2c(c1)CN(C(=O)N2)C
UNII:
W4VMH2E80M
Properties
Complexity:
434  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.112g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.281g/mol
Monoisotopic Mass:
258.112g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
73.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties