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245-52-3 | 1H-[1,4]Thiazino[4,3-a]benzimidazole (8CI,9CI)
CAS No: 245-52-3 Catalog No: AG002OC5 MDL No:
Product Description
Catalog Number:
AG002OC5
Chemical Name:
1H-[1,4]Thiazino[4,3-a]benzimidazole (8CI,9CI)
CAS Number:
245-52-3
Molecular Formula:
C10H8N2S
Molecular Weight:
188.2489
IUPAC Name:
1H-[1,4]thiazino[4,3-a]benzimidazole
InChI:
InChI=1S/C10H8N2S/c1-2-4-9-8(3-1)11-10-7-13-6-5-12(9)10/h1-6H,7H2
InChI Key:
YQXZTIISAXLRLZ-UHFFFAOYSA-N
SMILES:
S1C=Cn2c(C1)nc1c2cccc1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.041g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.248g/mol
Monoisotopic Mass:
188.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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