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Brd 4354

CAS No.:
315698-07-8
Catalog Number:
AG01E44J
Molecular Formula:
C21H23ClN4O
Molecular Weight:
382.8865
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$168
- +
10mg
98%
1 week
United States
$251
- +
25mg
98%
1 week
United States
$446
- +
50mg
98%
1 week
United States
$723
- +
100mg
98%
1 week
United States
$1182
- +
Product Description
Catalog Number:
AG01E44J
Chemical Name:
Brd 4354
CAS Number:
315698-07-8
Molecular Formula:
C21H23ClN4O
Molecular Weight:
382.8865
MDL Number:
MFCD02330682
IUPAC Name:
5-chloro-7-[(4-ethylpiperazin-1-yl)-pyridin-3-ylmethyl]quinolin-8-ol
InChI:
InChI=1S/C21H23ClN4O/c1-2-25-9-11-26(12-10-25)20(15-5-3-7-23-14-15)17-13-18(22)16-6-4-8-24-19(16)21(17)27/h3-8,13-14,20,27H,2,9-12H2,1H3
InChI Key:
XAFSFXYJOJWLJD-UHFFFAOYSA-N
SMILES:
CCN1CCN(CC1)C(c1cc(Cl)c2c(c1O)nccc2)c1cccnc1
Properties
Complexity:
473  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.156g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
382.892g/mol
Monoisotopic Mass:
382.156g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
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
Properties