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626209-31-2 | (2-Fluoro-benzyl)-(3-imidazol-1-yl-propyl)-amine
CAS No: 626209-31-2 Catalog No: AG01FO5B MDL No:
Product Description
Catalog Number:
AG01FO5B
Chemical Name:
(2-Fluoro-benzyl)-(3-imidazol-1-yl-propyl)-amine
CAS Number:
626209-31-2
IUPAC Name:
N-[(2-fluorophenyl)methyl]-3-imidazol-1-ylpropan-1-amine
InChI:
InChI=1S/C13H16FN3/c14-13-5-2-1-4-12(13)10-15-6-3-8-17-9-7-16-11-17/h1-2,4-5,7,9,11,15H,3,6,8,10H2
InChI Key:
HKHHKORRQXFOGZ-UHFFFAOYSA-N
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.133g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.29g/mol
Monoisotopic Mass:
233.133g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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