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144535-28-4 | Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione, 1,3-diethyl-
CAS No: 144535-28-4 Catalog No: AG001JQ4 MDL No:
Product Description
Catalog Number:
AG001JQ4
Chemical Name:
Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione, 1,3-diethyl-
CAS Number:
144535-28-4
Molecular Formula:
C15H15N3O2
Molecular Weight:
269.2985
IUPAC Name:
1,3-diethylpyrimido[4,5-b]quinoline-2,4-dione
InChI:
InChI=1S/C15H15N3O2/c1-3-17-13-11(14(19)18(4-2)15(17)20)9-10-7-5-6-8-12(10)16-13/h5-9H,3-4H2,1-2H3
InChI Key:
UKXMLSRHQDQJCI-UHFFFAOYSA-N
SMILES:
CCn1c2nc3ccccc3cc2c(=O)n(c1=O)CC
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.304g/mol
Monoisotopic Mass:
269.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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