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1021268-12-1 | Morpholine, 4,4'-(5-bromo-2,4-pyrimidinediyl)bis-
CAS No: 1021268-12-1 Catalog No: AG0006O3 MDL No:MFCD20491451
Product Description
Catalog Number:
AG0006O3
Chemical Name:
Morpholine, 4,4'-(5-bromo-2,4-pyrimidinediyl)bis-
CAS Number:
1021268-12-1
Molecular Formula:
C12H17BrN4O2
Molecular Weight:
329.1930
MDL Number:
MFCD20491451
IUPAC Name:
4-(5-bromo-2-morpholin-4-ylpyrimidin-4-yl)morpholine
InChI:
InChI=1S/C12H17BrN4O2/c13-10-9-14-12(17-3-7-19-8-4-17)15-11(10)16-1-5-18-6-2-16/h9H,1-8H2
InChI Key:
SXTDZEPZODMMLC-UHFFFAOYSA-N
SMILES:
Brc1cnc(nc1N1CCOCC1)N1CCOCC1
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.053g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.198g/mol
Monoisotopic Mass:
328.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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