5-chloro-N-[5-chloro-3-(oxan-4-ylmethyl)-1,3-thiazol-2-ylidene]-2-methoxybenzamide


Chemical Name: 5-chloro-N-[5-chloro-3-(oxan-4-ylmethyl)-1,3-thiazol-2-ylidene]-2-methoxybenzamide
CAS Number: 68060-49-1
Product Number: AG00ILPK(AGN-PC-04TJ9B)
Synonyms:
MDL No:
Molecular Formula: C41H65N13O10
Molecular Weight: 900.0359

Identification/Properties


Computed Properties
Molecular Weight:
900.052g/mol
XLogP3:
-6.1
Hydrogen Bond Donor Count:
11
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
27
Exact Mass:
899.498g/mol
Monoisotopic Mass:
899.498g/mol
Topological Polar Surface Area:
397A^2
Heavy Atom Count:
64
Formal Charge:
0
Complexity:
1670
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
7
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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