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42853-56-5

42853-56-5 | 2H-Benzo[g]thiazolo[5,4-e]indole(9CI)

CAS No: 42853-56-5 Catalog No: AG0071CJ MDL No:

Product Description

Catalog Number:
AG0071CJ
Chemical Name:
2H-Benzo[g]thiazolo[5,4-e]indole(9CI)
CAS Number:
42853-56-5
Molecular Formula:
C13H8N2S
Molecular Weight:
224.2810
IUPAC Name:
5-thia-3,10-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2,6,8,10,12,14-heptaene
InChI:
InChI=1S/C13H8N2S/c1-2-4-9-8(3-1)11-10(5-6-14-11)13-12(9)15-7-16-13/h1-6H,7H2
InChI Key:
CJUIDRHCICDBHE-UHFFFAOYSA-N
SMILES:
C1Sc2c(=N1)c1ccccc1c1=NC=Cc21

Properties

Complexity:
470  
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:
2.2  

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