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88820-46-6 | 2H-Pyrimido[1,2-b]pyridazin-2-one, 7-(4-morpholinyl)-
CAS No: 88820-46-6 Catalog No: AG004C49 MDL No:
Product Description
Catalog Number:
AG004C49
Chemical Name:
2H-Pyrimido[1,2-b]pyridazin-2-one, 7-(4-morpholinyl)-
CAS Number:
88820-46-6
Molecular Formula:
C11H12N4O2
Molecular Weight:
232.2386
IUPAC Name:
7-morpholin-4-ylpyrimido[1,2-b]pyridazin-2-one
InChI:
InChI=1S/C11H12N4O2/c16-11-3-4-15-9(12-11)1-2-10(13-15)14-5-7-17-8-6-14/h1-4H,5-8H2
InChI Key:
VCIOARGDJBCWKM-UHFFFAOYSA-N
SMILES:
O=c1ccn2c(n1)ccc(n2)N1CCOCC1
Properties
Complexity:
458
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.096g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.243g/mol
Monoisotopic Mass:
232.096g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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