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Home > Pyridines > 132757-79-0
132757-79-0 | Pyridazino[4,5-g]quinoxaline-2,6,9(1H)-trione, 7,8-dihydro-3-propyl-
CAS No: 132757-79-0 Catalog No: AG00114E MDL No:
Product Description
Catalog Number:
AG00114E
Chemical Name:
Pyridazino[4,5-g]quinoxaline-2,6,9(1H)-trione, 7,8-dihydro-3-propyl-
CAS Number:
132757-79-0
Molecular Formula:
C13H12N4O3
Molecular Weight:
272.2594
IUPAC Name:
3-propyl-7,8-dihydro-1H-pyridazino[4,5-g]quinoxaline-2,6,9-trione
InChI:
InChI=1S/C13H12N4O3/c1-2-3-8-13(20)15-10-5-7-6(4-9(10)14-8)11(18)16-17-12(7)19/h4-5H,2-3H2,1H3,(H,15,20)(H,16,18)(H,17,19)
InChI Key:
RKICNEMWMUSUMO-UHFFFAOYSA-N
SMILES:
CCCc1nc2cc3c(=O)[nH][nH]c(=O)c3cc2[nH]c1=O
Properties
Complexity:
502
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.091g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
272.264g/mol
Monoisotopic Mass:
272.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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