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Home > Indoles and Oxindole > 36820-81-2
36820-81-2 | 8-methoxy-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
CAS No: 36820-81-2 Catalog No: AG00JD0N MDL No:MFCD01692760
Product Description
Catalog Number:
AG00JD0N
Chemical Name:
8-methoxy-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
CAS Number:
36820-81-2
Molecular Formula:
C11H9N3O2
Molecular Weight:
215.2081
MDL Number:
MFCD01692760
IUPAC Name:
8-methoxy-3,5-dihydropyridazino[4,5-b]indol-4-one
InChI:
InChI=1S/C11H9N3O2/c1-16-6-2-3-9-7(4-6)8-5-12-14-11(15)10(8)13-9/h2-5,13H,1H3,(H,14,15)
InChI Key:
JJFRRONWXDVIDD-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c1cn[nH]c(=O)c1[nH]2
NSC Number:
629657
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.069g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.212g/mol
Monoisotopic Mass:
215.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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