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168811-39-0 | 2H-Thiazolo[5,4-c]carbazole (9CI)
CAS No: 168811-39-0 Catalog No: AG001YBK MDL No:
Product Description
Catalog Number:
AG001YBK
Chemical Name:
2H-Thiazolo[5,4-c]carbazole (9CI)
CAS Number:
168811-39-0
Molecular Formula:
C13H8N2S
Molecular Weight:
224.2810
IUPAC Name:
2H-[1,3]thiazolo[5,4-c]carbazole
InChI:
InChI=1S/C13H8N2S/c1-2-4-9-8(3-1)12-10(15-9)5-6-11-13(12)14-7-16-11/h1-6H,7H2
InChI Key:
ZGUPQZVBWVUDJQ-UHFFFAOYSA-N
SMILES:
c1ccc2=Nc3c(=c2c1)c1=NCSc1cc3
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:
2.1
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