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141991-07-3 | 1,3-Dioxolo[4,5-b]acridin-10-amine, N-phenyl-
CAS No: 141991-07-3 Catalog No: AG001HHK MDL No:
Product Description
Catalog Number:
AG001HHK
Chemical Name:
1,3-Dioxolo[4,5-b]acridin-10-amine, N-phenyl-
CAS Number:
141991-07-3
Molecular Formula:
C20H14N2O2
Molecular Weight:
314.3374
IUPAC Name:
N-phenyl-[1,3]dioxolo[4,5-b]acridin-10-amine
InChI:
InChI=1S/C20H14N2O2/c1-2-6-13(7-3-1)21-20-14-8-4-5-9-16(14)22-17-11-19-18(10-15(17)20)23-12-24-19/h1-11H,12H2,(H,21,22)
InChI Key:
WYQILPBTXSQWAQ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Nc1c2ccccc2nc2c1cc1OCOc1c2
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.106g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.344g/mol
Monoisotopic Mass:
314.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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