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124533-68-2 | 4-Quinolinamine, 8-fluoro-N-[2-(2-thienyl)ethyl]-
CAS No: 124533-68-2 Catalog No: AG000M6F MDL No:
Product Description
Catalog Number:
AG000M6F
Chemical Name:
4-Quinolinamine, 8-fluoro-N-[2-(2-thienyl)ethyl]-
CAS Number:
124533-68-2
Molecular Formula:
C15H13FN2S
Molecular Weight:
272.3405
IUPAC Name:
8-fluoro-N-(2-thiophen-2-ylethyl)quinolin-4-amine
InChI:
InChI=1S/C15H13FN2S/c16-13-5-1-4-12-14(7-9-18-15(12)13)17-8-6-11-3-2-10-19-11/h1-5,7,9-10H,6,8H2,(H,17,18)
InChI Key:
ICVDYFIRSNABJZ-UHFFFAOYSA-N
SMILES:
Fc1cccc2c1nccc2NCCc1cccs1
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.341g/mol
Monoisotopic Mass:
272.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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