Home Aminos N-{[4-(aminomethyl)-1,3-thiazol-2-yl]methyl}benzamide

N-{[4-(aminomethyl)-1,3-thiazol-2-yl]methyl}benzamide

CAS No.:
1376044-35-7
Catalog Number:
AG019U2K
Molecular Formula:
C12H13N3OS
Molecular Weight:
247.3161
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Product Description
Catalog Number:
AG019U2K
Chemical Name:
N-{[4-(aminomethyl)-1,3-thiazol-2-yl]methyl}benzamide
CAS Number:
1376044-35-7
Molecular Formula:
C12H13N3OS
Molecular Weight:
247.3161
MDL Number:
MFCD21602715
IUPAC Name:
N-[[4-(aminomethyl)-1,3-thiazol-2-yl]methyl]benzamide
InChI:
InChI=1S/C12H13N3OS/c13-6-10-8-17-11(15-10)7-14-12(16)9-4-2-1-3-5-9/h1-5,8H,6-7,13H2,(H,14,16)
InChI Key:
GNNNUYNKBXYROZ-UHFFFAOYSA-N
SMILES:
NCc1csc(n1)CNC(=O)c1ccccc1
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.078g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.316g/mol
Monoisotopic Mass:
247.078g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties