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329026-00-8 | 5,9-Methanothiazolo[5,4-i][3]benzazocine(9CI)
CAS No: 329026-00-8 Catalog No: AG00D4KA MDL No:
Product Description
Catalog Number:
AG00D4KA
Chemical Name:
5,9-Methanothiazolo[5,4-i][3]benzazocine(9CI)
CAS Number:
329026-00-8
IUPAC Name:
7-thia-5,14-diazatetracyclo[10.3.1.02,10.04,8]hexadeca-1,3,5,8,10,12,14-heptaene
InChI:
InChI=1S/C13H8N2S/c1-8-2-10(6-14-5-8)11-4-12-13(3-9(1)11)16-7-15-12/h1,3-7H,2H2
InChI Key:
PTECYBAZNRIJJK-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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