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2060050-95-3 | imino(methyl)(4-methylquinolin-2-yl)-lambda6-sulfanone
CAS No: 2060050-95-3 Catalog No: AG01B72F MDL No:MFCD30345073
Product Description
Catalog Number:
AG01B72F
Chemical Name:
imino(methyl)(4-methylquinolin-2-yl)-lambda6-sulfanone
CAS Number:
2060050-95-3
Molecular Formula:
C11H12N2OS
Molecular Weight:
220.2908
MDL Number:
MFCD30345073
IUPAC Name:
imino-methyl-(4-methylquinolin-2-yl)-oxo-λ6-sulfane
InChI:
InChI=1S/C11H12N2OS/c1-8-7-11(15(2,12)14)13-10-6-4-3-5-9(8)10/h3-7,12H,1-2H3
InChI Key:
NLXVHWVWMKFFJC-UHFFFAOYSA-N
SMILES:
Cc1cc(nc2c1cccc2)S(=O)(=N)C
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.29g/mol
Monoisotopic Mass:
220.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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