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841260-29-5 | 1,2-Ethanediamine, N-[2-(2-naphthalenyl)-4-quinolinyl]-
CAS No: 841260-29-5 Catalog No: AG004SSD MDL No:
Product Description
Catalog Number:
AG004SSD
Chemical Name:
1,2-Ethanediamine, N-[2-(2-naphthalenyl)-4-quinolinyl]-
CAS Number:
841260-29-5
Molecular Formula:
C21H19N3
Molecular Weight:
313.3957
IUPAC Name:
N'-(2-naphthalen-2-ylquinolin-4-yl)ethane-1,2-diamine
InChI:
InChI=1S/C21H19N3/c22-11-12-23-21-14-20(24-19-8-4-3-7-18(19)21)17-10-9-15-5-1-2-6-16(15)13-17/h1-10,13-14H,11-12,22H2,(H,23,24)
InChI Key:
KWFZWXJENVNFHB-UHFFFAOYSA-N
SMILES:
NCCNc1cc(nc2c1cccc2)c1ccc2c(c1)cccc2
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.158g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
313.404g/mol
Monoisotopic Mass:
313.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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