Home Other Building Blocks 1-benzyl-5-methoxy-1H-1,3-benzodiazol-2-amine

1-benzyl-5-methoxy-1H-1,3-benzodiazol-2-amine

CAS No.:
33235-34-6
Catalog Number:
AG01BXWZ
Molecular Formula:
C15H15N3O
Molecular Weight:
253.2991
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Product Description
Catalog Number:
AG01BXWZ
Chemical Name:
1-benzyl-5-methoxy-1H-1,3-benzodiazol-2-amine
CAS Number:
33235-34-6
Molecular Formula:
C15H15N3O
Molecular Weight:
253.2991
MDL Number:
MFCD03678109
IUPAC Name:
1-benzyl-5-methoxybenzimidazol-2-amine
InChI:
InChI=1S/C15H15N3O/c1-19-12-7-8-14-13(9-12)17-15(16)18(14)10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H2,16,17)
InChI Key:
WYNXIKPFBBSWFR-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)nc(n2Cc1ccccc1)N
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.122g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.305g/mol
Monoisotopic Mass:
253.122g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties