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105664-73-1 | 3H-Imidazo[4,5-g]quinazoline-4,8,9(5H)-trione, 2,3-dimethyl-
CAS No: 105664-73-1 Catalog No: AG00846F MDL No:
Product Description
Catalog Number:
AG00846F
Chemical Name:
3H-Imidazo[4,5-g]quinazoline-4,8,9(5H)-trione, 2,3-dimethyl-
CAS Number:
105664-73-1
Molecular Formula:
C11H8N4O3
Molecular Weight:
244.2062
IUPAC Name:
2,3-dimethyl-7H-imidazo[4,5-g]quinazoline-4,8,9-trione
InChI:
InChI=1S/C11H8N4O3/c1-4-14-7-8(15(4)2)10(17)6-5(9(7)16)11(18)13-3-12-6/h3H,1-2H3,(H,12,13,18)
InChI Key:
FKHYFHLCLOJQBU-UHFFFAOYSA-N
SMILES:
Cn1c(C)nc2c1c(=O)c1[nH]cnc(=O)c1c2=O
NSC Number:
601909
Properties
Complexity:
536
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.06g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.21g/mol
Monoisotopic Mass:
244.06g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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