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Home > Other Heterocycles > 92918-36-0
92918-36-0 | 1,2,8,9-Tetraazadispiro[4.1.4.2]trideca-1,8-dien-6-one, 4,11-diphenyl-
CAS No: 92918-36-0 Catalog No: AG006K9E MDL No:
Product Description
Catalog Number:
AG006K9E
Chemical Name:
1,2,8,9-Tetraazadispiro[4.1.4.2]trideca-1,8-dien-6-one, 4,11-diphenyl-
CAS Number:
92918-36-0
Molecular Formula:
C21H20N4O
Molecular Weight:
344.4097
IUPAC Name:
1,11-diphenyl-3,4,8,9-tetrazadispiro[4.1.47.25]trideca-3,8-dien-6-one
InChI:
InChI=1S/C21H20N4O/c26-19-20(17(13-22-24-20)15-7-3-1-4-8-15)11-12-21(19)18(14-23-25-21)16-9-5-2-6-10-16/h1-10,17-18H,11-14H2
InChI Key:
CFTMNJWGHOHPKY-UHFFFAOYSA-N
SMILES:
O=C1C2(CCC31N=NCC3c1ccccc1)N=NCC2c1ccccc1
Properties
Complexity:
568
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.164g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.418g/mol
Monoisotopic Mass:
344.164g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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