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23564-94-5 | 3-Pyridinecarboximidamide, N-(3,4,5-trimethoxyphenyl)-
CAS No: 23564-94-5 Catalog No: AG002NP2 MDL No:
Product Description
Catalog Number:
AG002NP2
Chemical Name:
3-Pyridinecarboximidamide, N-(3,4,5-trimethoxyphenyl)-
CAS Number:
23564-94-5
Molecular Formula:
C15H17N3O3
Molecular Weight:
287.3138
IUPAC Name:
N'-(3,4,5-trimethoxyphenyl)pyridine-3-carboximidamide
InChI:
InChI=1S/C15H17N3O3/c1-19-12-7-11(8-13(20-2)14(12)21-3)18-15(16)10-5-4-6-17-9-10/h4-9H,1-3H3,(H2,16,18)
InChI Key:
TXHHBTIHUYSISJ-UHFFFAOYSA-N
SMILES:
COc1cc(NC(=N)c2cccnc2)cc(c1OC)OC
Properties
Complexity:
337
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:
1
Isotope Atom Count:
0
Molecular Weight:
287.319g/mol
Monoisotopic Mass:
287.127g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
79A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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