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Sbe 13 hydrochloride

CAS No.:
1052532-15-6
Catalog Number:
AG007F78
Molecular Formula:
C24H28Cl2N2O4
Molecular Weight:
479.3961
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥98%
1 week
United States
$153
- +
10mg
≥98%
1 week
United States
$182
- +
25mg
≥98%
1 week
United States
$321
- +
50mg
≥98%
1 week
United States
$536
- +
Product Description
Catalog Number:
AG007F78
Chemical Name:
Sbe 13 hydrochloride
CAS Number:
1052532-15-6
Molecular Formula:
C24H28Cl2N2O4
Molecular Weight:
479.3961
MDL Number:
MFCD20036266
IUPAC Name:
N-[[4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine;hydrochloride
InChI:
InChI=1S/C24H27ClN2O4.ClH/c1-28-20-7-4-17(12-22(20)29-2)10-11-26-14-18-5-8-21(23(13-18)30-3)31-16-19-6-9-24(25)27-15-19;/h4-9,12-13,15,26H,10-11,14,16H2,1-3H3;1H
InChI Key:
QBGSVDJLQQXEGG-UHFFFAOYSA-N
SMILES:
COc1cc(CNCCc2ccc(c(c2)OC)OC)ccc1OCc1ccc(nc1)Cl.Cl
Properties
Complexity:
500  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
478.143g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
479.398g/mol
Monoisotopic Mass:
478.143g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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