4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine

C434H275N17O10S10 — CID 157426996

IUPAC4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine
SMILESCC(C)(C)c1ccc(-c2cccc3c2oc2ccc(N(c4ccc5oc6ccccc6c5c4)c4ccc5sc6cc7c8ccccc8c8ccccc8c7cc6c5c4)cc23)cc1.CC(C)(C)c1ccnc(N(c2ccc3oc4ccccc4c3c2)c2ccc3sc4cc5c6ccccc6c6ccccc6c5cc4c3c2)c1.CC(C)c1ccc(N(c2ccc3sc4cc5c6ccc(N(c7ccc(C(C)C)cc7)c7cccc8c7oc7ccccc78)cc6c6ccccc6c5cc4c3c2)c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(N(c4ccc5oc6cc7c8ccccc8c8ccccc8c7cc6c5c4)c4ccc5sc6ccccc6c5c4)cc3)n2)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc5oc6cc7c8ccccc8c8ccccc8c7cc6c5c4)c4ccc5sc6ccccc6c5c4)ccc32)cc1.c1ccc(N(c2ccc3oc4cc5c6ccc(N(c7ccccc7)c7cccc8c7sc7ccccc78)cc6c6ccccc6c5cc4c3c2)c2cccc3c2sc2ccccc23)cc1.c1ccc2c(c1)oc1ccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4sc5cc6c7ccccc7c7ccccc7c6cc5c4c3)cc12.c1ccc2c(c1)sc1ccc(N(c3ccc(-c4cncnc4)cc3)c3ccc4oc5cc6c7ccccc7c7ccccc7c6cc5c4c3)cc12
InChIInChI=1S/C66H48N2O2S.C60H36N2OS2.C58H39NO2S.C57H34N4OS.C54H32N2OS.C48H27NOS2.C46H27N3OS.C45H32N2OS/c1-39(2)41-23-27-43(28-24-41)67(59-19-11-17-52-50-15-7-9-21-61(50)69-65(52)59)45-31-33-49-54(35-45)47-13-5-6-14-48(47)55-37-58-57-36-46(32-34-63(57)71-64(58)38-56(49)55)68(44-29-25-42(26-30-44)40(3)4)60-20-12-18-53-51-16-8-10-22-62(51)70-66(53)60;1-3-15-37(16-4-1)61(53-25-13-23-46-44-21-9-11-27-57(44)64-59(46)53)39-29-31-43-48(33-39)41-19-7-8-20-42(41)49-35-52-51-34-40(30-32-55(51)63-56(52)36-50(43)49)62(38-17-5-2-6-18-38)54-26-14-24-47-45-22-10-12-28-58(45)65-60(47)54;1-58(2,3)35-21-19-34(20-22-35)39-16-10-17-45-49-30-37(24-27-54(49)61-57(39)45)59(36-23-26-53-48(29-36)44-15-8-9-18-52(44)60-53)38-25-28-55-50(31-38)51-32-46-42-13-6-4-11-40(42)41-12-5-7-14-43(41)47(46)33-56(51)62-55;1-3-13-35(14-4-1)55-58-56(36-15-5-2-6-16-36)60-57(59-55)37-23-25-38(26-24-37)61(40-28-30-54-50(32-40)45-21-11-12-22-53(45)63-54)39-27-29-51-48(31-39)49-33-46-43-19-9-7-17-41(43)42-18-8-10-20-44(42)47(46)34-52(49)62-51;1-2-12-33(13-3-1)56-49-20-10-8-18-41(49)45-28-34(22-25-50(45)56)55(36-24-27-54-48(30-36)42-19-9-11-21-53(42)58-54)35-23-26-51-46(29-35)47-31-43-39-16-6-4-14-37(39)38-15-5-7-17-40(38)44(43)32-52(47)57-51;1-3-11-33-31(9-1)32-10-2-4-12-34(32)38-27-48-42(26-37(33)38)41-25-30(19-22-47(41)52-48)49(28-17-20-44-39(23-28)35-13-5-7-15-43(35)50-44)29-18-21-46-40(24-29)36-14-6-8-16-45(36)51-46;1-3-9-35-33(7-1)34-8-2-4-10-36(34)39-24-44-41(23-38(35)39)40-21-31(17-19-43(40)50-44)49(30-15-13-28(14-16-30)29-25-47-27-48-26-29)32-18-20-46-42(22-32)37-11-5-6-12-45(37)51-46;1-45(2,3)27-20-21-46-44(22-27)47(28-16-18-41-37(23-28)34-14-8-9-15-40(34)48-41)29-17-19-42-38(24-29)39-25-35-32-12-6-4-10-30(32)31-11-5-7-13-33(31)36(35)26-43(39)49-42/h5-40H,1-4H3;1-36H;4-33H,1-3H3;1-34H;1-32H;1-27H;1-27H;4-26H,1-3H3
InChIKeyBQBOLHWBJHIERC-UHFFFAOYSA-N
MW6208.75 g/mol
LogP131.18
Rot. Bonds38

About 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine

4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine (PubChem CID 157426996) has the molecular formula C434H275N17O10S10 and a molecular weight of 6208.75 g/mol. Its IUPAC name is 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine.

Molecular Properties

Compound Name4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine
PubChem CID157426996
Molecular FormulaC434H275N17O10S10
Molecular Weight6208.75 g/mol
Exact Mass6202.87
IUPAC Name4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine
SMILESCC(C)(C)c1ccc(-c2cccc3c2oc2ccc(N(c4ccc5oc6ccccc6c5c4)c4ccc5sc6cc7c8ccccc8c8ccccc8c7cc6c5c4)cc23)cc1.CC(C)(C)c1ccnc(N(c2ccc3oc4ccccc4c3c2)c2ccc3sc4cc5c6ccccc6c6ccccc6c5cc4c3c2)c1.CC(C)c1ccc(N(c2ccc3sc4cc5c6ccc(N(c7ccc(C(C)C)cc7)c7cccc8c7oc7ccccc78)cc6c6ccccc6c5cc4c3c2)c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(N(c4ccc5oc6cc7c8ccccc8c8ccccc8c7cc6c5c4)c4ccc5sc6ccccc6c5c4)cc3)n2)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc5oc6cc7c8ccccc8c8ccccc8c7cc6c5c4)c4ccc5sc6ccccc6c5c4)ccc32)cc1.c1ccc(N(c2ccc3oc4cc5c6ccc(N(c7ccccc7)c7cccc8c7sc7ccccc78)cc6c6ccccc6c5cc4c3c2)c2cccc3c2sc2ccccc23)cc1.c1ccc2c(c1)oc1ccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4sc5cc6c7ccccc7c7ccccc7c6cc5c4c3)cc12.c1ccc2c(c1)sc1ccc(N(c3ccc(-c4cncnc4)cc3)c3ccc4oc5cc6c7ccccc7c7ccccc7c6cc5c4c3)cc12
InChIInChI=1S/C66H48N2O2S.C60H36N2OS2.C58H39NO2S.C57H34N4OS.C54H32N2OS.C48H27NOS2.C46H27N3OS.C45H32N2OS/c1-39(2)41-23-27-43(28-24-41)67(59-19-11-17-52-50-15-7-9-21-61(50)69-65(52)59)45-31-33-49-54(35-45)47-13-5-6-14-48(47)55-37-58-57-36-46(32-34-63(57)71-64(58)38-56(49)55)68(44-29-25-42(26-30-44)40(3)4)60-20-12-18-53-51-16-8-10-22-62(51)70-66(53)60;1-3-15-37(16-4-1)61(53-25-13-23-46-44-21-9-11-27-57(44)64-59(46)53)39-29-31-43-48(33-39)41-19-7-8-20-42(41)49-35-52-51-34-40(30-32-55(51)63-56(52)36-50(43)49)62(38-17-5-2-6-18-38)54-26-14-24-47-45-22-10-12-28-58(45)65-60(47)54;1-58(2,3)35-21-19-34(20-22-35)39-16-10-17-45-49-30-37(24-27-54(49)61-57(39)45)59(36-23-26-53-48(29-36)44-15-8-9-18-52(44)60-53)38-25-28-55-50(31-38)51-32-46-42-13-6-4-11-40(42)41-12-5-7-14-43(41)47(46)33-56(51)62-55;1-3-13-35(14-4-1)55-58-56(36-15-5-2-6-16-36)60-57(59-55)37-23-25-38(26-24-37)61(40-28-30-54-50(32-40)45-21-11-12-22-53(45)63-54)39-27-29-51-48(31-39)49-33-46-43-19-9-7-17-41(43)42-18-8-10-20-44(42)47(46)34-52(49)62-51;1-2-12-33(13-3-1)56-49-20-10-8-18-41(49)45-28-34(22-25-50(45)56)55(36-24-27-54-48(30-36)42-19-9-11-21-53(42)58-54)35-23-26-51-46(29-35)47-31-43-39-16-6-4-14-37(39)38-15-5-7-17-40(38)44(43)32-52(47)57-51;1-3-11-33-31(9-1)32-10-2-4-12-34(32)38-27-48-42(26-37(33)38)41-25-30(19-22-47(41)52-48)49(28-17-20-44-39(23-28)35-13-5-7-15-43(35)50-44)29-18-21-46-40(24-29)36-14-6-8-16-45(36)51-46;1-3-9-35-33(7-1)34-8-2-4-10-36(34)39-24-44-41(23-38(35)39)40-21-31(17-19-43(40)50-44)49(30-15-13-28(14-16-30)29-25-47-27-48-26-29)32-18-20-46-42(22-32)37-11-5-6-12-45(37)51-46;1-45(2,3)27-20-21-46-44(22-27)47(28-16-18-41-37(23-28)34-14-8-9-15-40(34)48-41)29-17-19-42-38(24-29)39-25-35-32-12-6-4-10-30(32)31-11-5-7-13-33(31)36(35)26-43(39)49-42/h5-40H,1-4H3;1-36H;4-33H,1-3H3;1-34H;1-32H;1-27H;1-27H;4-26H,1-3H3
InChIKeyBQBOLHWBJHIERC-UHFFFAOYSA-N
XLogP131.18
TPSA246.07 Ų
H-Bond Donors
H-Bond Acceptors37
Rotatable Bonds38
Heavy Atoms471
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006208.75
LogP ≤ 5131.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1037

Analyze 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine?
The IUPAC name of 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine (CID 157426996) is 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine.
What is the SMILES notation for 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine?
The canonical SMILES for 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine is CC(C)(C)c1ccc(-c2cccc3c2oc2ccc(N(c4ccc5oc6ccccc6c5c4)c4ccc5sc6cc7c8ccccc8c8ccccc8c7cc6c5c4)cc23)cc1.CC(C)(C)c1ccnc(N(c2ccc3oc4ccccc4c3c2)c2ccc3sc4cc5c6ccccc6c6ccccc6c5cc4c3c2)c1.CC(C)c1ccc(N(c2ccc3sc4cc5c6ccc(N(c7ccc(C(C)C)cc7)c7cccc8c7oc7ccccc78)cc6c6ccccc6c5cc4c3c2)c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(N(c4ccc5oc6cc7c8ccccc8c8ccccc8c7cc6c5c4)c4ccc5sc6ccccc6c5c4)cc3)n2)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc5oc6cc7c8ccccc8c8ccccc8c7cc6c5c4)c4ccc5sc6ccccc6c5c4)ccc32)cc1.c1ccc(N(c2ccc3oc4cc5c6ccc(N(c7ccccc7)c7cccc8c7sc7ccccc78)cc6c6ccccc6c5cc4c3c2)c2cccc3c2sc2ccccc23)cc1.c1ccc2c(c1)oc1ccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4sc5cc6c7ccccc7c7ccccc7c6cc5c4c3)cc12.c1ccc2c(c1)sc1ccc(N(c3ccc(-c4cncnc4)cc3)c3ccc4oc5cc6c7ccccc7c7ccccc7c6cc5c4c3)cc12.
What is the InChIKey of 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine?
The InChIKey is BQBOLHWBJHIERC-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H48N2O2S.C60H36N2OS2.C58H39NO2S.C57H34N4OS.C54H32N2OS.C48H27NOS2.C46H27N3OS.C45H32N2OS/c1-39(2)41-23-27-43(28-24-41)67(59-19-11-17-52-50-15-7-9-21-61(50)69-65(52)59)45-31-33-49-54(35-45)47-13-5-6-14-48(47)55-37-58-57-36-46(32-34-63(57)71-64(58)38-56(49)55)68(44-29-25-42(26-30-44)40(3)4)60-20-12-18-53-51-16-8-10-22-62(51)70-66(53)60;1-3-15-37(16-4-1)61(53-25-13-23-46-44-21-9-11-27-57(44)64-59(46)53)39-29-31-43-48(33-39)41-19-7-8-20-42(41)49-35-52-51-34-40(30-32-55(51)63-56(52)36-50(43)49)62(38-17-5-2-6-18-38)54-26-14-24-47-45-22-10-12-28-58(45)65-60(47)54;1-58(2,3)35-21-19-34(20-22-35)39-16-10-17-45-49-30-37(24-27-54(49)61-57(39)45)59(36-23-26-53-48(29-36)44-15-8-9-18-52(44)60-53)38-25-28-55-50(31-38)51-32-46-42-13-6-4-11-40(42)41-12-5-7-14-43(41)47(46)33-56(51)62-55;1-3-13-35(14-4-1)55-58-56(36-15-5-2-6-16-36)60-57(59-55)37-23-25-38(26-24-37)61(40-28-30-54-50(32-40)45-21-11-12-22-53(45)63-54)39-27-29-51-48(31-39)49-33-46-43-19-9-7-17-41(43)42-18-8-10-20-44(42)47(46)34-52(49)62-51;1-2-12-33(13-3-1)56-49-20-10-8-18-41(49)45-28-34(22-25-50(45)56)55(36-24-27-54-48(30-36)42-19-9-11-21-53(42)58-54)35-23-26-51-46(29-35)47-31-43-39-16-6-4-14-37(39)38-15-5-7-17-40(38)44(43)32-52(47)57-51;1-3-11-33-31(9-1)32-10-2-4-12-34(32)38-27-48-42(26-37(33)38)41-25-30(19-22-47(41)52-48)49(28-17-20-44-39(23-28)35-13-5-7-15-43(35)50-44)29-18-21-46-40(24-29)36-14-6-8-16-45(36)51-46;1-3-9-35-33(7-1)34-8-2-4-10-36(34)39-24-44-41(23-38(35)39)40-21-31(17-19-43(40)50-44)49(30-15-13-28(14-16-30)29-25-47-27-48-26-29)32-18-20-46-42(22-32)37-11-5-6-12-45(37)51-46;1-45(2,3)27-20-21-46-44(22-27)47(28-16-18-41-37(23-28)34-14-8-9-15-40(34)48-41)29-17-19-42-38(24-29)39-25-35-32-12-6-4-10-30(32)31-11-5-7-13-33(31)36(35)26-43(39)49-42/h5-40H,1-4H3;1-36H;4-33H,1-3H3;1-34H;1-32H;1-27H;1-27H;4-26H,1-3H3.
What are the key properties of 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine?
4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine has a molecular weight of 6208.75 g/mol, XLogP of 131.18, 38 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)pyridin-2-amine;6-(4-tert-butylphenyl)-N-dibenzofuran-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;N-dibenzothiophen-2-yl-N-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)-9-phenylcarbazol-3-amine;N-dibenzothiophen-2-yl-N-(4-pyrimidin-5-ylphenyl)-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-amine;N-dibenzothiophen-2-yl-N-(23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaen-19-yl)dibenzofuran-2-amine;5-N,19-N-di(dibenzofuran-4-yl)-5-N,19-N-bis(4-propan-2-ylphenyl)-23-thiahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine;5-N,19-N-di(dibenzothiophen-4-yl)-5-N,19-N-diphenyl-23-oxahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17(22),18,20-dodecaene-5,19-diamine is sourced from PubChem (CID 157426996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).