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Home > Indoles and Oxindole > 79652-37-2
79652-37-2 | 8-methyl-3H,4H,5H-pyridazino[4,5-b]indol-4-one
CAS No: 79652-37-2 Catalog No: AG019L2L MDL No:MFCD03285075
Product Description
Catalog Number:
AG019L2L
Chemical Name:
8-methyl-3H,4H,5H-pyridazino[4,5-b]indol-4-one
CAS Number:
79652-37-2
Molecular Formula:
C11H9N3O
Molecular Weight:
199.2087
MDL Number:
MFCD03285075
IUPAC Name:
8-methyl-3,5-dihydropyridazino[4,5-b]indol-4-one
InChI:
InChI=1S/C11H9N3O/c1-6-2-3-9-7(4-6)8-5-12-14-11(15)10(8)13-9/h2-5,13H,1H3,(H,14,15)
InChI Key:
VBWJMUHVGCOFHX-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c1cn[nH]c(=O)c1[nH]2
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.075g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.213g/mol
Monoisotopic Mass:
199.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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