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Ncgc00244536

CAS No.:
2003260-55-5
Catalog Number:
AG00BJEG
Molecular Formula:
C25H22N2O2
Molecular Weight:
382.4544
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
98%
1 week
United States
$240
- +
5mg
98%
1 week
United States
$607
- +
10mg
98%
1 week
United States
$890
- +
50mg
98%
1 week
United States
$2557
- +
100mg
98%
1 week
United States
$3557
- +
Product Description
Catalog Number:
AG00BJEG
Chemical Name:
Ncgc00244536
CAS Number:
2003260-55-5
Molecular Formula:
C25H22N2O2
Molecular Weight:
382.4544
MDL Number:
MFCD31382180
IUPAC Name:
3-(8-hydroxyquinolin-6-yl)-N-(3-phenylpropyl)benzamide
InChI:
InChI=1S/C25H22N2O2/c28-23-17-22(16-20-12-6-13-26-24(20)23)19-10-4-11-21(15-19)25(29)27-14-5-9-18-7-2-1-3-8-18/h1-4,6-8,10-13,15-17,28H,5,9,14H2,(H,27,29)
InChI Key:
NYKBXXGHEMXSBB-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)c1cc(O)c2c(c1)cccn2)NCCCc1ccccc1
Properties
Complexity:
519  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.168g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
382.463g/mol
Monoisotopic Mass:
382.168g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties