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67755-06-0 | thiazinoisoquinolone
CAS No: 67755-06-0 Catalog No: AG00FZ3F MDL No:
Product Description
Catalog Number:
AG00FZ3F
Chemical Name:
thiazinoisoquinolone
CAS Number:
67755-06-0
IUPAC Name:
3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
InChI:
InChI=1S/C12H11NOS/c14-12-10-5-2-1-4-9(10)8-11-13(12)6-3-7-15-11/h1-2,4-5,8H,3,6-7H2
InChI Key:
LNKBYMKMJSTWOH-UHFFFAOYSA-N
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.056g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.286g/mol
Monoisotopic Mass:
217.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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