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165067-13-0 | Quinoline,3-(2-benzothiazolyl)-
CAS No: 165067-13-0 Catalog No: AG007VAQ MDL No:
Product Description
Catalog Number:
AG007VAQ
Chemical Name:
Quinoline,3-(2-benzothiazolyl)-
CAS Number:
165067-13-0
Molecular Formula:
C16H10N2S
Molecular Weight:
262.3290
IUPAC Name:
2-quinolin-3-yl-1,3-benzothiazole
InChI:
InChI=1S/C16H10N2S/c1-2-6-13-11(5-1)9-12(10-17-13)16-18-14-7-3-4-8-15(14)19-16/h1-10H
InChI Key:
RMVNOKZNFAMOLE-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)cc(cn2)c1nc2c(s1)cccc2
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.056g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.33g/mol
Monoisotopic Mass:
262.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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