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24898-95-1

24898-95-1 | 9H-Imidazo[4,5-f]quinazolin-9-one, 8-butyl-1,8-dihydro-2-methyl-

CAS No: 24898-95-1 Catalog No: AG002PS8 MDL No:

Product Description

Catalog Number:
AG002PS8
Chemical Name:
9H-Imidazo[4,5-f]quinazolin-9-one, 8-butyl-1,8-dihydro-2-methyl-
CAS Number:
24898-95-1
Molecular Formula:
C14H16N4O
Molecular Weight:
256.3030
IUPAC Name:
8-butyl-2-methyl-3H-imidazo[4,5-f]quinazolin-9-one
InChI:
InChI=1S/C14H16N4O/c1-3-4-7-18-8-15-10-5-6-11-13(12(10)14(18)19)17-9(2)16-11/h5-6,8H,3-4,7H2,1-2H3,(H,16,17)
InChI Key:
JKKSHBAHRNPENM-UHFFFAOYSA-N
SMILES:
CCCCn1cnc2c(c1=O)c1[nH]c(nc1cc2)C
NSC Number:
131393

Properties

Complexity:
384  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.132g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.309g/mol
Monoisotopic Mass:
256.132g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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