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114284-70-7 | 1,3-Dioxolo[4,5-g]quinolin-6-amine, N,N-diethyl-7-phenyl-
CAS No: 114284-70-7 Catalog No: AG000AYJ MDL No:
Product Description
Catalog Number:
AG000AYJ
Chemical Name:
1,3-Dioxolo[4,5-g]quinolin-6-amine, N,N-diethyl-7-phenyl-
CAS Number:
114284-70-7
Molecular Formula:
C20H20N2O2
Molecular Weight:
320.3850
IUPAC Name:
N,N-diethyl-7-phenyl-[1,3]dioxolo[4,5-g]quinolin-6-amine
InChI:
InChI=1S/C20H20N2O2/c1-3-22(4-2)20-16(14-8-6-5-7-9-14)10-15-11-18-19(24-13-23-18)12-17(15)21-20/h5-12H,3-4,13H2,1-2H3
InChI Key:
WCYDZNBNRLPYID-UHFFFAOYSA-N
SMILES:
CCN(c1nc2cc3OCOc3cc2cc1c1ccccc1)CC
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.152g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.392g/mol
Monoisotopic Mass:
320.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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