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2003260-55-5 | Benzamide, 3-(8-hydroxy-6-quinolinyl)-N-(3-phenylpropyl)-
CAS No: 2003260-55-5 Catalog No: AG00BJEG MDL No:
Product Description
Catalog Number:
AG00BJEG
Chemical Name:
Benzamide, 3-(8-hydroxy-6-quinolinyl)-N-(3-phenylpropyl)-
CAS Number:
2003260-55-5
Molecular Formula:
C25H22N2O2
Molecular Weight:
382.4544
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
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