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245-58-9 | 2H-[1,3]Thiazino[3,2-a]benzimidazole (8CI,9CI)
CAS No: 245-58-9 Catalog No: AG002OC1 MDL No:
Product Description
Catalog Number:
AG002OC1
Chemical Name:
2H-[1,3]Thiazino[3,2-a]benzimidazole (8CI,9CI)
CAS Number:
245-58-9
Molecular Formula:
C10H8N2S
Molecular Weight:
188.2489
IUPAC Name:
2H-[1,3]thiazino[3,2-a]benzimidazole
InChI:
InChI=1S/C10H8N2S/c1-2-5-9-8(4-1)11-10-12(9)6-3-7-13-10/h1-6H,7H2
InChI Key:
XGIRELGQSVHYNJ-UHFFFAOYSA-N
SMILES:
C1C=Cn2c(S1)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:
2.4
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