Home Other Building Blocks 1-PIPERIDIN-4-YL-AZEPANE

1-PIPERIDIN-4-YL-AZEPANE

CAS No.:
436099-86-4
Catalog Number:
AG00D9G3
Molecular Formula:
C11H24Cl2N2
Molecular Weight:
255.2277
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Product Description
Catalog Number:
AG00D9G3
Chemical Name:
1-PIPERIDIN-4-YL-AZEPANE
CAS Number:
436099-86-4
Molecular Formula:
C11H24Cl2N2
Molecular Weight:
255.2277
MDL Number:
MFCD03274734
IUPAC Name:
1-piperidin-4-ylazepane
InChI:
InChI=1S/C11H22N2/c1-2-4-10-13(9-3-1)11-5-7-12-8-6-11/h11-12H,1-10H2
InChI Key:
YEXWRRMPRFUMJW-UHFFFAOYSA-N
SMILES:
C1CCCN(CC1)C1CCNCC1.Cl.Cl
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.178g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.311g/mol
Monoisotopic Mass:
182.178g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties