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88138-20-9

88138-20-9 | Benzamide, N-[4-[[6-(1H-imidazol-1-yl)hexyl]oxy]-2-methylphenyl]-

CAS No: 88138-20-9 Catalog No: AG008C3B MDL No:

Product Description

Catalog Number:
AG008C3B
Chemical Name:
Benzamide, N-[4-[[6-(1H-imidazol-1-yl)hexyl]oxy]-2-methylphenyl]-
CAS Number:
88138-20-9
Molecular Formula:
C23H27N3O2
Molecular Weight:
377.4794
IUPAC Name:
N-[4-(6-imidazol-1-ylhexoxy)-2-methylphenyl]benzamide
InChI:
InChI=1S/C23H27N3O2/c1-19-17-21(28-16-8-3-2-7-14-26-15-13-24-18-26)11-12-22(19)25-23(27)20-9-5-4-6-10-20/h4-6,9-13,15,17-18H,2-3,7-8,14,16H2,1H3,(H,25,27)
InChI Key:
YHYMJJKSVKXESX-UHFFFAOYSA-N
SMILES:
Cc1cc(OCCCCCCn2cncc2)ccc1NC(=O)c1ccccc1

Properties

Complexity:
453  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.21g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
377.488g/mol
Monoisotopic Mass:
377.21g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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