6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene

C296H175N9O14S2 — CID 157174014

IUPAC6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
SMILESCC1(C)c2ccccc2-c2cc(-n3c4cc5ccccc5cc4c4cc5oc6ccccc6c5cc43)ccc21.CC1(C)c2ccccc2-c2cc(-n3c4ccc5ccccc5c4c4ccc5c6ccccc6oc5c43)ccc21.c1ccc2c(c1)ccc1c2c2ccc3c4ccccc4oc3c2n1-c1ccc2oc3ccccc3c2c1.c1ccc2c(c1)oc1c2c2ccccc2c2c3ccccc3n(-c3ccc4sc5ccccc5c4c3)c12.c1ccc2c(c1)oc1c2c2ccccc2n1-c1ccc2sc3ccccc3c2c1.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5ccccc5c5c6ccccc6oc5c43)cc12.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5ccccc5oc43)cc12.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5oc6ccccc6c5c5ccccc5c43)cc12.c1ccc2cc3c(cc2c1)c1cc2oc4ccccc4c2cc1n3-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/2C37H25NO.4C34H19NO2.C34H19NOS.C26H15NO2.C26H15NOS/c1-37(2)30-13-7-5-11-25(30)29-21-23(16-19-31(29)37)38-32-20-15-22-9-3-4-10-24(22)34(32)28-18-17-27-26-12-6-8-14-33(26)39-36(27)35(28)38;1-37(2)31-13-7-5-11-25(31)27-19-24(15-16-32(27)37)38-33-18-23-10-4-3-9-22(23)17-28(33)29-21-36-30(20-34(29)38)26-12-6-8-14-35(26)39-36;1-2-11-23-22(10-1)31-25-13-5-8-16-29(25)37-34(31)32-24-12-3-6-14-27(24)35(33(23)32)20-17-18-30-26(19-20)21-9-4-7-15-28(21)36-30;1-2-11-23-22(10-1)31-24-12-3-6-14-27(24)35(33(31)34-32(23)25-13-5-8-16-29(25)37-34)20-17-18-30-26(19-20)21-9-4-7-15-28(21)36-30;1-2-8-22-20(7-1)13-17-28-32(22)26-16-15-25-23-9-3-6-12-30(23)37-34(25)33(26)35(28)21-14-18-31-27(19-21)24-10-4-5-11-29(24)36-31;1-2-8-21-16-29-25(15-20(21)7-1)26-19-34-28(24-10-4-6-12-32(24)37-34)18-30(26)35(29)22-13-14-33-27(17-22)23-9-3-5-11-31(23)36-33;1-2-11-23-22(10-1)31-24-12-3-6-14-27(24)35(33(31)34-32(23)25-13-4-7-15-28(25)36-34)20-17-18-30-26(19-20)21-9-5-8-16-29(21)37-30;1-4-10-21-18(8-1)25-19-9-3-6-12-23(19)29-26(25)27(21)16-13-14-24-20(15-16)17-7-2-5-11-22(17)28-24;1-4-10-21-18(8-1)25-19-9-2-5-11-22(19)28-26(25)27(21)16-13-14-24-20(15-16)17-7-3-6-12-23(17)29-24/h2*3-21H,1-2H3;5*1-19H;2*1-15H
InChIKeyANUJZMITNISPLN-UHFFFAOYSA-N
MW4145.84 g/mol
LogP84.76
Rot. Bonds9

About 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene

6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene (PubChem CID 157174014) has the molecular formula C296H175N9O14S2 and a molecular weight of 4145.84 g/mol. Its IUPAC name is 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene.

Molecular Properties

Compound Name6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
PubChem CID157174014
Molecular FormulaC296H175N9O14S2
Molecular Weight4145.84 g/mol
Exact Mass4142.27
IUPAC Name6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
SMILESCC1(C)c2ccccc2-c2cc(-n3c4cc5ccccc5cc4c4cc5oc6ccccc6c5cc43)ccc21.CC1(C)c2ccccc2-c2cc(-n3c4ccc5ccccc5c4c4ccc5c6ccccc6oc5c43)ccc21.c1ccc2c(c1)ccc1c2c2ccc3c4ccccc4oc3c2n1-c1ccc2oc3ccccc3c2c1.c1ccc2c(c1)oc1c2c2ccccc2c2c3ccccc3n(-c3ccc4sc5ccccc5c4c3)c12.c1ccc2c(c1)oc1c2c2ccccc2n1-c1ccc2sc3ccccc3c2c1.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5ccccc5c5c6ccccc6oc5c43)cc12.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5ccccc5oc43)cc12.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5oc6ccccc6c5c5ccccc5c43)cc12.c1ccc2cc3c(cc2c1)c1cc2oc4ccccc4c2cc1n3-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/2C37H25NO.4C34H19NO2.C34H19NOS.C26H15NO2.C26H15NOS/c1-37(2)30-13-7-5-11-25(30)29-21-23(16-19-31(29)37)38-32-20-15-22-9-3-4-10-24(22)34(32)28-18-17-27-26-12-6-8-14-33(26)39-36(27)35(28)38;1-37(2)31-13-7-5-11-25(31)27-19-24(15-16-32(27)37)38-33-18-23-10-4-3-9-22(23)17-28(33)29-21-36-30(20-34(29)38)26-12-6-8-14-35(26)39-36;1-2-11-23-22(10-1)31-25-13-5-8-16-29(25)37-34(31)32-24-12-3-6-14-27(24)35(33(23)32)20-17-18-30-26(19-20)21-9-4-7-15-28(21)36-30;1-2-11-23-22(10-1)31-24-12-3-6-14-27(24)35(33(31)34-32(23)25-13-5-8-16-29(25)37-34)20-17-18-30-26(19-20)21-9-4-7-15-28(21)36-30;1-2-8-22-20(7-1)13-17-28-32(22)26-16-15-25-23-9-3-6-12-30(23)37-34(25)33(26)35(28)21-14-18-31-27(19-21)24-10-4-5-11-29(24)36-31;1-2-8-21-16-29-25(15-20(21)7-1)26-19-34-28(24-10-4-6-12-32(24)37-34)18-30(26)35(29)22-13-14-33-27(17-22)23-9-3-5-11-31(23)36-33;1-2-11-23-22(10-1)31-24-12-3-6-14-27(24)35(33(31)34-32(23)25-13-4-7-15-28(25)36-34)20-17-18-30-26(19-20)21-9-5-8-16-29(21)37-30;1-4-10-21-18(8-1)25-19-9-3-6-12-23(19)29-26(25)27(21)16-13-14-24-20(15-16)17-7-2-5-11-22(17)28-24;1-4-10-21-18(8-1)25-19-9-2-5-11-22(19)28-26(25)27(21)16-13-14-24-20(15-16)17-7-3-6-12-23(17)29-24/h2*3-21H,1-2H3;5*1-19H;2*1-15H
InChIKeyANUJZMITNISPLN-UHFFFAOYSA-N
XLogP84.76
TPSA228.33 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds9
Heavy Atoms321
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004145.84
LogP ≤ 584.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Analyze 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene with MolForge

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What is the IUPAC name of 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
The IUPAC name of 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene (CID 157174014) is 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene.
What is the SMILES notation for 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
The canonical SMILES for 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene is CC1(C)c2ccccc2-c2cc(-n3c4cc5ccccc5cc4c4cc5oc6ccccc6c5cc43)ccc21.CC1(C)c2ccccc2-c2cc(-n3c4ccc5ccccc5c4c4ccc5c6ccccc6oc5c43)ccc21.c1ccc2c(c1)ccc1c2c2ccc3c4ccccc4oc3c2n1-c1ccc2oc3ccccc3c2c1.c1ccc2c(c1)oc1c2c2ccccc2c2c3ccccc3n(-c3ccc4sc5ccccc5c4c3)c12.c1ccc2c(c1)oc1c2c2ccccc2n1-c1ccc2sc3ccccc3c2c1.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5ccccc5c5c6ccccc6oc5c43)cc12.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5ccccc5oc43)cc12.c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5oc6ccccc6c5c5ccccc5c43)cc12.c1ccc2cc3c(cc2c1)c1cc2oc4ccccc4c2cc1n3-c1ccc2oc3ccccc3c2c1.
What is the InChIKey of 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
The InChIKey is ANUJZMITNISPLN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C37H25NO.4C34H19NO2.C34H19NOS.C26H15NO2.C26H15NOS/c1-37(2)30-13-7-5-11-25(30)29-21-23(16-19-31(29)37)38-32-20-15-22-9-3-4-10-24(22)34(32)28-18-17-27-26-12-6-8-14-33(26)39-36(27)35(28)38;1-37(2)31-13-7-5-11-25(31)27-19-24(15-16-32(27)37)38-33-18-23-10-4-3-9-22(23)17-28(33)29-21-36-30(20-34(29)38)26-12-6-8-14-35(26)39-36;1-2-11-23-22(10-1)31-25-13-5-8-16-29(25)37-34(31)32-24-12-3-6-14-27(24)35(33(23)32)20-17-18-30-26(19-20)21-9-4-7-15-28(21)36-30;1-2-11-23-22(10-1)31-24-12-3-6-14-27(24)35(33(31)34-32(23)25-13-5-8-16-29(25)37-34)20-17-18-30-26(19-20)21-9-4-7-15-28(21)36-30;1-2-8-22-20(7-1)13-17-28-32(22)26-16-15-25-23-9-3-6-12-30(23)37-34(25)33(26)35(28)21-14-18-31-27(19-21)24-10-4-5-11-29(24)36-31;1-2-8-21-16-29-25(15-20(21)7-1)26-19-34-28(24-10-4-6-12-32(24)37-34)18-30(26)35(29)22-13-14-33-27(17-22)23-9-3-5-11-31(23)36-33;1-2-11-23-22(10-1)31-24-12-3-6-14-27(24)35(33(31)34-32(23)25-13-4-7-15-28(25)36-34)20-17-18-30-26(19-20)21-9-5-8-16-29(21)37-30;1-4-10-21-18(8-1)25-19-9-3-6-12-23(19)29-26(25)27(21)16-13-14-24-20(15-16)17-7-2-5-11-22(17)28-24;1-4-10-21-18(8-1)25-19-9-2-5-11-22(19)28-26(25)27(21)16-13-14-24-20(15-16)17-7-3-6-12-23(17)29-24/h2*3-21H,1-2H3;5*1-19H;2*1-15H.
What are the key properties of 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene?
6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene has a molecular weight of 4145.84 g/mol, XLogP of 84.76, 9 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 6-dibenzofuran-2-yl-[1]benzofuro[2,3-b]indole;9-dibenzofuran-2-yl-24-oxa-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene;12-dibenzofuran-2-yl-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-dibenzofuran-2-yl-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene;24-dibenzofuran-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;6-dibenzothiophen-2-yl-[1]benzofuro[2,3-b]indole;24-dibenzothiophen-2-yl-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-(9,9-dimethylfluoren-3-yl)-15-oxa-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(9,9-dimethylfluoren-3-yl)-22-oxa-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene is sourced from PubChem (CID 157174014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).