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90290-95-2

90290-95-2 | Benzamide, 4-cyano-N-[1-(4-morpholinylcarbonyl)-2-phenylethenyl]-

CAS No: 90290-95-2 Catalog No: AG006GM8 MDL No:

Product Description

Catalog Number:
AG006GM8
Chemical Name:
Benzamide, 4-cyano-N-[1-(4-morpholinylcarbonyl)-2-phenylethenyl]-
CAS Number:
90290-95-2
Molecular Formula:
C21H19N3O3
Molecular Weight:
361.3939
IUPAC Name:
4-cyano-N-(3-morpholin-4-yl-3-oxo-1-phenylprop-1-en-2-yl)benzamide
InChI:
InChI=1S/C21H19N3O3/c22-15-17-6-8-18(9-7-17)20(25)23-19(14-16-4-2-1-3-5-16)21(26)24-10-12-27-13-11-24/h1-9,14H,10-13H2,(H,23,25)
InChI Key:
MZFYQMVYMUZSBC-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C(=O)NC(=Cc1ccccc1)C(=O)N1CCOCC1

Properties

Complexity:
601  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.143g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
361.401g/mol
Monoisotopic Mass:
361.143g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.2  

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