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88447-12-5 | 3H-Pyrano[2,3-c]isoquinolin-3-one, 2,6-diphenyl-
CAS No: 88447-12-5 Catalog No: AG004EMK MDL No:
Product Description
Catalog Number:
AG004EMK
Chemical Name:
3H-Pyrano[2,3-c]isoquinolin-3-one, 2,6-diphenyl-
CAS Number:
88447-12-5
Molecular Formula:
C24H15NO2
Molecular Weight:
349.3814
IUPAC Name:
2,6-diphenylpyrano[2,3-c]isoquinolin-3-one
InChI:
InChI=1S/C24H15NO2/c26-24-20(16-9-3-1-4-10-16)15-21-18-13-7-8-14-19(18)22(25-23(21)27-24)17-11-5-2-6-12-17/h1-15H
InChI Key:
LYGJHEZIKXGOLP-UHFFFAOYSA-N
SMILES:
O=c1oc2nc(c3ccccc3)c3c(c2cc1c1ccccc1)cccc3
Properties
Complexity:
573
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.11g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.389g/mol
Monoisotopic Mass:
349.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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