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114499-68-2 | Benzamide, 2-amino-4,5-dimethoxy-N-(2-pyridinylmethyl)-
CAS No: 114499-68-2 Catalog No: AG000EKO MDL No:
Product Description
Catalog Number:
AG000EKO
Chemical Name:
Benzamide, 2-amino-4,5-dimethoxy-N-(2-pyridinylmethyl)-
CAS Number:
114499-68-2
Molecular Formula:
C15H17N3O3
Molecular Weight:
287.3138
IUPAC Name:
2-amino-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide
InChI:
InChI=1S/C15H17N3O3/c1-20-13-7-11(12(16)8-14(13)21-2)15(19)18-9-10-5-3-4-6-17-10/h3-8H,9,16H2,1-2H3,(H,18,19)
InChI Key:
VLRBPUMBOVBUDN-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)NCc2ccccn2)c(cc1OC)N
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.127g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
287.319g/mol
Monoisotopic Mass:
287.127g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
86.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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