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685140-67-4 | 6,10-Methanothiazolo[4,5-i][3]benzazocine(9CI)
CAS No: 685140-67-4 Catalog No: AG00G1S0 MDL No:
Product Description
Catalog Number:
AG00G1S0
Chemical Name:
6,10-Methanothiazolo[4,5-i][3]benzazocine(9CI)
CAS Number:
685140-67-4
IUPAC Name:
7-thia-5,13-diazatetracyclo[10.3.1.02,10.04,8]hexadeca-1,3,5,8,10,12,14-heptaene
InChI:
InChI=1S/C13H8N2S/c1-2-14-10-3-8(1)11-6-12-13(16-7-15-12)5-9(11)4-10/h1-2,4-7H,3H2
InChI Key:
FKASLLULJXIWKW-UHFFFAOYSA-N
Properties
Complexity:
610
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.041g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.281g/mol
Monoisotopic Mass:
224.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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