Home Halogens {[4-(3-bromophenyl)-1,3-thiazol-2-yl]methyl}(2-methoxyethyl)amine

{[4-(3-bromophenyl)-1,3-thiazol-2-yl]methyl}(2-methoxyethyl)amine

CAS No.:
1281656-41-4
Catalog Number:
AG01AD46
Molecular Formula:
C13H15BrN2OS
Molecular Weight:
327.2400
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Product Description
Catalog Number:
AG01AD46
Chemical Name:
{[4-(3-bromophenyl)-1,3-thiazol-2-yl]methyl}(2-methoxyethyl)amine
CAS Number:
1281656-41-4
Molecular Formula:
C13H15BrN2OS
Molecular Weight:
327.2400
MDL Number:
MFCD18033907
IUPAC Name:
N-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]methyl]-2-methoxyethanamine
InChI:
InChI=1S/C13H15BrN2OS/c1-17-6-5-15-8-13-16-12(9-18-13)10-3-2-4-11(14)7-10/h2-4,7,9,15H,5-6,8H2,1H3
InChI Key:
RFFINDRNHRWEDY-UHFFFAOYSA-N
SMILES:
COCCNCc1scc(n1)c1cccc(c1)Br
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.009g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
327.24g/mol
Monoisotopic Mass:
326.009g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties