About 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile
11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile (PubChem CID 158727719) has the molecular formula C189H42F39N45O14
and a molecular weight of 3907.64 g/mol. Its IUPAC name is 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile.
Frequently Asked Questions
What is the IUPAC name of 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile?
The IUPAC name of 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile (CID 158727719) is 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile.
What is the SMILES notation for 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile?
The canonical SMILES for 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile is N#Cc1cc2c(=O)n3c4cc(F)ccc4nc3c3ccc4c(=O)n5c6cc(C(F)(F)F)ccc6nc5c1c4c23.N#Cc1nc2c3ccc4c(=O)n5c(nc6c(F)c(F)c(F)c(F)c65)c5ccc(c(=O)n2c1C#N)c3c45.N#Cc1nc2c3ccc4c(=O)n5c6cc(C(F)(F)F)cc(C(F)(F)F)c6nc5c5ccc(c(=O)n2c1C#N)c3c45.N#Cc1nc2c3ccc4c(=O)n5c6cc(C(F)(F)F)ccc6nc5c5ccc(c(=O)n2c1C#N)c3c45.N#Cc1nc2nc3c4ccc5c(=O)n6c(nc7c(F)c(F)c(F)c(F)c76)c6ccc(c(=O)n3c2nc1C#N)c4c56.N#Cc1nc2nc3c4ccc5c(=O)n6c7cc(C(F)(F)F)cc(C(F)(F)F)c7nc6c6ccc(c(=O)n3c2nc1C#N)c4c56.[C-]#[N+]c1cc2c(=O)n3c4cc(C(F)(F)F)cc(C(F)(F)F)c4nc3c3c(C#N)cc4c(=O)n5c6cc(C(F)(F)F)cc(C(F)(F)F)c6nc5c1c4c23.
What is the InChIKey of 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile?
The InChIKey is IKSHPNZDNBXNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H6F12N6O2.C28H6F6N8O2.C28H9F4N5O2.C26H6F6N6O2.C26H4F4N8O2.C25H7F3N6O2.C24H4F4N6O2/c1-46-16-7-13-20-19(25-47-23-14(31(39,40)41)3-10(29(33,34)35)5-17(23)49(25)28(13)52)9(8-45)2-12-21(20)22(16)26-48-24-15(32(42,43)44)4-11(30(36,37)38)6-18(24)50(26)27(12)51;29-27(30,31)9-5-14(28(32,33)34)20-17(6-9)41-22(39-20)10-1-4-13-19-11(2-3-12(18(10)19)25(41)43)23-40-21-24(42(23)26(13)44)38-16(8-36)15(7-35)37-21;29-13-2-6-18-20(9-13)36-24(34-18)14-3-4-15-23-21(11(10-33)7-16(22(14)23)27(36)39)25-35-17-5-1-12(28(30,31)32)8-19(17)37(25)26(15)38;27-25(28,29)9-5-14(26(30,31)32)20-16(6-9)37-22(36-20)11-2-4-13-18-10(1-3-12(19(11)18)23(37)39)21-35-15(7-33)17(8-34)38(21)24(13)40;27-15-16(28)18(30)20-19(17(15)29)35-22-7-1-4-10-14-8(2-3-9(13(7)14)25(39)37(20)22)23-36-21-24(38(23)26(10)40)34-12(6-32)11(5-31)33-21;26-25(27,28)10-1-6-15-17(7-10)33-21(31-15)11-2-5-14-20-12(3-4-13(19(11)20)23(33)35)22-32-16(8-29)18(9-30)34(22)24(14)36;25-15-16(26)18(28)20-19(17(15)27)32-22-8-2-3-9-13-7(1-4-10(14(8)13)24(36)34(20)22)21-31-11(5-29)12(6-30)33(21)23(9)35/h2-7H;1-6H;1-9H;1-6H;1-4H;1-7H;1-4H.
What are the key properties of 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile?
11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile has a molecular weight of 3907.64 g/mol, XLogP of 34.98, 0 rotatable bonds, 0 hydrogen bond donors, and 58 hydrogen bond acceptors.
Where does this data come from?
All data for 11,25-dioxo-19,21-bis(trifluoromethyl)-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-6,7-dicarbonitrile;11,21-dioxo-5,7-bis(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4,6,8,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile;11,21-dioxo-7-(trifluoromethyl)-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(25),2,4(9),5,7,12,14,16,18,22(26),23-undecaene-18,19-dicarbonitrile;7-fluoro-11,25-dioxo-21-(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4(9),5,7,12,14,16,18(23),19,21,26(30),27-tridecaene-14-carbonitrile;28-isocyano-11,25-dioxo-5,7,19,21-tetrakis(trifluoromethyl)-3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18,20,22,26-tridecaene-14-carbonitrile;19,20,21,22-tetrafluoro-11,25-dioxo-3,5,8,10,17,24-hexazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(28),2,4,6,8,12(29),13,15(30),16,18(23),19,21,26-tridecaene-6,7-dicarbonitrile;5,6,7,8-tetrafluoro-11,21-dioxo-3,10,17,20-tetrazaheptacyclo[13.9.2.02,10.04,9.012,25.016,20.022,26]hexacosa-1(24),2,4(9),5,7,12(25),13,15(26),16,18,22-undecaene-18,19-dicarbonitrile is sourced from PubChem (CID 158727719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).