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16153-81-4

16153-81-4 | Benzenamine, 4-(4-methyl-1-piperazinyl)-

CAS No: 16153-81-4 Catalog No: AG001VO1 MDL No:MFCD00172703

Product Description

Catalog Number:
AG001VO1
Chemical Name:
Benzenamine, 4-(4-methyl-1-piperazinyl)-
CAS Number:
16153-81-4
Molecular Formula:
C11H17N3
Molecular Weight:
191.2728
MDL Number:
MFCD00172703
IUPAC Name:
4-(4-methylpiperazin-1-yl)aniline
InChI:
InChI=1S/C11H17N3/c1-13-6-8-14(9-7-13)11-4-2-10(12)3-5-11/h2-5H,6-9,12H2,1H3
InChI Key:
MOZNZNKHRXRLLF-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1ccc(cc1)N

Properties

Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.142g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.278g/mol
Monoisotopic Mass:
191.142g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Literature

Title Journal
Antistaphylococcal activity of DNA-interactive pyrrolobenzodiazepine (PBD) dimers and PBD-biaryl conjugates. The Journal of antimicrobial chemotherapy 20120701
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Structure-affinity relationships of a unique nicotinic ligand: N(1)-dimethyl-N(4)-phenylpiperazinium iodide (DMPP). Journal of medicinal chemistry 20011108

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