4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine

C420H252N24S12 — CID 167674696

IUPAC4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine
SMILESc1ccc(-c2cc(-c3ccc(-c4ccc5c(c4)sc4ccccc45)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccc8c(c7)sc7ccccc78)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccc8sc9ccccc9c8c7)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc4c(c3)sc3ccccc34)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc7c(c6)sc6ccccc67)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc4sc5ccccc5c4c3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc7sc8ccccc8c7c6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3cccc4c3sc3ccccc34)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6cccc7c6sc6ccccc67)n5)ccc43)n2)cc1
InChIInChI=1S/3C76H46N4S2.3C64H38N4S2/c1-3-15-47(16-4-1)65-43-67(49-33-29-45(30-34-49)53-23-13-25-61-55-19-9-11-27-69(55)81-73(53)61)79-75(77-65)51-37-39-59-63(41-51)71-57-21-7-8-22-58(57)72(59)64-42-52(38-40-60(64)71)76-78-66(48-17-5-2-6-18-48)44-68(80-76)50-35-31-46(32-36-50)54-24-14-26-62-56-20-10-12-28-70(56)82-74(54)62;1-3-13-47(14-4-1)65-43-67(49-27-23-45(24-28-49)51-33-37-71-61(39-51)55-17-9-11-21-69(55)81-71)79-75(77-65)53-31-35-59-63(41-53)73-57-19-7-8-20-58(57)74(59)64-42-54(32-36-60(64)73)76-78-66(48-15-5-2-6-16-48)44-68(80-76)50-29-25-46(26-30-50)52-34-38-72-62(40-52)56-18-10-12-22-70(56)82-72;1-3-13-47(14-4-1)65-43-67(49-27-23-45(24-28-49)51-31-35-57-55-17-9-11-21-69(55)81-71(57)41-51)79-75(77-65)53-33-37-61-63(39-53)73-59-19-7-8-20-60(59)74(61)64-40-54(34-38-62(64)73)76-78-66(48-15-5-2-6-16-48)44-68(80-76)50-29-25-46(26-30-50)52-32-36-58-56-18-10-12-22-70(56)82-72(58)42-52;1-3-15-37(16-4-1)53-35-55(49-25-13-23-47-41-19-9-11-27-57(41)69-61(47)49)67-63(65-53)39-29-31-45-51(33-39)59-43-21-7-8-22-44(43)60(45)52-34-40(30-32-46(52)59)64-66-54(38-17-5-2-6-18-38)36-56(68-64)50-26-14-24-48-42-20-10-12-28-58(42)70-62(48)50;1-3-13-37(14-4-1)53-35-55(39-25-29-59-49(31-39)43-17-9-11-21-57(43)69-59)67-63(65-53)41-23-27-47-51(33-41)61-45-19-7-8-20-46(45)62(47)52-34-42(24-28-48(52)61)64-66-54(38-15-5-2-6-16-38)36-56(68-64)40-26-30-60-50(32-40)44-18-10-12-22-58(44)70-60;1-3-13-37(14-4-1)53-35-55(39-23-27-45-43-17-9-11-21-57(43)69-59(45)33-39)67-63(65-53)41-25-29-49-51(31-41)61-47-19-7-8-20-48(47)62(49)52-32-42(26-30-50(52)61)64-66-54(38-15-5-2-6-16-38)36-56(68-64)40-24-28-46-44-18-10-12-22-58(44)70-60(46)34-40/h1-44,71-72H;2*1-44,73-74H;1-36,59-60H;2*1-36,61-62H/t71-,72?;2*73-,74?;59-,60?;2*61-,62?/m111111/s1
InChIKeyUQGJMBCXXDWNEB-MZOSSPNRSA-N
MW6019.61 g/mol
LogP111.95
Rot. Bonds42

About 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine

4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine (PubChem CID 167674696) has the molecular formula C420H252N24S12 and a molecular weight of 6019.61 g/mol. Its IUPAC name is 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine.

Molecular Properties

Compound Name4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine
PubChem CID167674696
Molecular FormulaC420H252N24S12
Molecular Weight6019.61 g/mol
Exact Mass6013.71
IUPAC Name4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine
SMILESc1ccc(-c2cc(-c3ccc(-c4ccc5c(c4)sc4ccccc45)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccc8c(c7)sc7ccccc78)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccc8sc9ccccc9c8c7)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc4c(c3)sc3ccccc34)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc7c(c6)sc6ccccc67)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc4sc5ccccc5c4c3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc7sc8ccccc8c7c6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3cccc4c3sc3ccccc34)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6cccc7c6sc6ccccc67)n5)ccc43)n2)cc1
InChIInChI=1S/3C76H46N4S2.3C64H38N4S2/c1-3-15-47(16-4-1)65-43-67(49-33-29-45(30-34-49)53-23-13-25-61-55-19-9-11-27-69(55)81-73(53)61)79-75(77-65)51-37-39-59-63(41-51)71-57-21-7-8-22-58(57)72(59)64-42-52(38-40-60(64)71)76-78-66(48-17-5-2-6-18-48)44-68(80-76)50-35-31-46(32-36-50)54-24-14-26-62-56-20-10-12-28-70(56)82-74(54)62;1-3-13-47(14-4-1)65-43-67(49-27-23-45(24-28-49)51-33-37-71-61(39-51)55-17-9-11-21-69(55)81-71)79-75(77-65)53-31-35-59-63(41-53)73-57-19-7-8-20-58(57)74(59)64-42-54(32-36-60(64)73)76-78-66(48-15-5-2-6-16-48)44-68(80-76)50-29-25-46(26-30-50)52-34-38-72-62(40-52)56-18-10-12-22-70(56)82-72;1-3-13-47(14-4-1)65-43-67(49-27-23-45(24-28-49)51-31-35-57-55-17-9-11-21-69(55)81-71(57)41-51)79-75(77-65)53-33-37-61-63(39-53)73-59-19-7-8-20-60(59)74(61)64-40-54(34-38-62(64)73)76-78-66(48-15-5-2-6-16-48)44-68(80-76)50-29-25-46(26-30-50)52-32-36-58-56-18-10-12-22-70(56)82-72(58)42-52;1-3-15-37(16-4-1)53-35-55(49-25-13-23-47-41-19-9-11-27-57(41)69-61(47)49)67-63(65-53)39-29-31-45-51(33-39)59-43-21-7-8-22-44(43)60(45)52-34-40(30-32-46(52)59)64-66-54(38-17-5-2-6-18-38)36-56(68-64)50-26-14-24-48-42-20-10-12-28-58(42)70-62(48)50;1-3-13-37(14-4-1)53-35-55(39-25-29-59-49(31-39)43-17-9-11-21-57(43)69-59)67-63(65-53)41-23-27-47-51(33-41)61-45-19-7-8-20-46(45)62(47)52-34-42(24-28-48(52)61)64-66-54(38-15-5-2-6-16-38)36-56(68-64)40-26-30-60-50(32-40)44-18-10-12-22-58(44)70-60;1-3-13-37(14-4-1)53-35-55(39-23-27-45-43-17-9-11-21-57(43)69-59(45)33-39)67-63(65-53)41-25-29-49-51(31-41)61-47-19-7-8-20-48(47)62(49)52-32-42(26-30-50(52)61)64-66-54(38-15-5-2-6-16-38)36-56(68-64)40-24-28-46-44-18-10-12-22-58(44)70-60(46)34-40/h1-44,71-72H;2*1-44,73-74H;1-36,59-60H;2*1-36,61-62H/t71-,72?;2*73-,74?;59-,60?;2*61-,62?/m111111/s1
InChIKeyUQGJMBCXXDWNEB-MZOSSPNRSA-N
XLogP111.95
TPSA309.36 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds42
Heavy Atoms456
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006019.61
LogP ≤ 5111.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Analyze 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine with MolForge

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Related Compounds

4-[4-[8-[8-[3-dibenzothiophen-2-yl-5-[6-(4-dibenzothiophen-4-ylphenyl)-2-phenylpyrimidin-4-yl]phenyl]dibenzothiophen-3-yl]dibenzothiophen-4-yl]phenyl]-6-[3,5-di(dibenzothiophen-4-yl)phenyl]-2-phenylpyrimidine
CID 137465889
4-(2-dibenzothiophen-2-ylphenyl)-6-[11-[6-(2-dibenzothiophen-2-ylphenyl)-2-phenylpyrimidin-4-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-2-phenylpyrimidine
CID 165150692
2-[11-[6-(3-dibenzothiophen-2-ylphenyl)-2-phenylpyrimidin-4-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-4,6-diphenyl-1,3,5-triazine
CID 165150874
2-dibenzothiophen-3-yl-4-[4-(8-phenyldibenzothiophen-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 168850235
2-dibenzothiophen-2-yl-4-(3-dibenzothiophen-4-yl-5-phenylphenyl)-6-phenylpyrimidine
CID 171583300
4,6-bis(4-dibenzothiophen-1-ylphenyl)-2-phenylpyrimidine;4,6-bis(4-dibenzothiophen-2-ylphenyl)-2-phenylpyrimidine;4,6-bis(4-dibenzothiophen-3-ylphenyl)-2-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-6-(4-dibenzothiophen-4-ylphenyl)-2-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-6-(4-naphthalen-2-ylphenyl)-2-phenylpyrimidine
CID 157307725
2-dibenzothiophen-4-yl-4-[4-[11-[4-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]phenyl]-6-phenyl-1,3,5-triazine
CID 165151379
2-[3-(8-dibenzothiophen-4-yldibenzothiophen-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 155377191
4-(4-dibenzothiophen-1-ylphenyl)-2-[11-[4-(4-dibenzothiophen-1-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine
CID 165151179
2,4-bis(4-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazine;2-(3-dibenzothiophen-2-ylphenyl)-4-(4-dibenzothiophen-2-ylphenyl)-6-phenyl-1,3,5-triazine;2-(4-dibenzothiophen-2-ylphenyl)-4-(4-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazine;2-(4-dibenzothiophen-2-ylphenyl)-6-phenyl-4-(4-triphenylen-2-ylphenyl)pyridine
CID 159098528
4-(4-dibenzothiophen-4-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 153301922
2-[11-[6-(4-dibenzothiophen-1-ylphenyl)-2-phenylpyrimidin-4-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-4,6-diphenyl-1,3,5-triazine
CID 165151275

Frequently Asked Questions

What is the IUPAC name of 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine?
The IUPAC name of 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine (CID 167674696) is 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine.
What is the SMILES notation for 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine?
The canonical SMILES for 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine is c1ccc(-c2cc(-c3ccc(-c4ccc5c(c4)sc4ccccc45)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccc8c(c7)sc7ccccc78)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccc8sc9ccccc9c8c7)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc4c(c3)sc3ccccc34)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc7c(c6)sc6ccccc67)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccc4sc5ccccc5c4c3)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6ccc7sc8ccccc8c7c6)n5)ccc43)n2)cc1.c1ccc(-c2cc(-c3cccc4c3sc3ccccc34)nc(-c3ccc4c(c3)C3c5ccccc5[C@H]4c4cc(-c5nc(-c6ccccc6)cc(-c6cccc7c6sc6ccccc67)n5)ccc43)n2)cc1.
What is the InChIKey of 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine?
The InChIKey is UQGJMBCXXDWNEB-MZOSSPNRSA-N. The full InChI is InChI=1S/3C76H46N4S2.3C64H38N4S2/c1-3-15-47(16-4-1)65-43-67(49-33-29-45(30-34-49)53-23-13-25-61-55-19-9-11-27-69(55)81-73(53)61)79-75(77-65)51-37-39-59-63(41-51)71-57-21-7-8-22-58(57)72(59)64-42-52(38-40-60(64)71)76-78-66(48-17-5-2-6-18-48)44-68(80-76)50-35-31-46(32-36-50)54-24-14-26-62-56-20-10-12-28-70(56)82-74(54)62;1-3-13-47(14-4-1)65-43-67(49-27-23-45(24-28-49)51-33-37-71-61(39-51)55-17-9-11-21-69(55)81-71)79-75(77-65)53-31-35-59-63(41-53)73-57-19-7-8-20-58(57)74(59)64-42-54(32-36-60(64)73)76-78-66(48-15-5-2-6-16-48)44-68(80-76)50-29-25-46(26-30-50)52-34-38-72-62(40-52)56-18-10-12-22-70(56)82-72;1-3-13-47(14-4-1)65-43-67(49-27-23-45(24-28-49)51-31-35-57-55-17-9-11-21-69(55)81-71(57)41-51)79-75(77-65)53-33-37-61-63(39-53)73-59-19-7-8-20-60(59)74(61)64-40-54(34-38-62(64)73)76-78-66(48-15-5-2-6-16-48)44-68(80-76)50-29-25-46(26-30-50)52-32-36-58-56-18-10-12-22-70(56)82-72(58)42-52;1-3-15-37(16-4-1)53-35-55(49-25-13-23-47-41-19-9-11-27-57(41)69-61(47)49)67-63(65-53)39-29-31-45-51(33-39)59-43-21-7-8-22-44(43)60(45)52-34-40(30-32-46(52)59)64-66-54(38-17-5-2-6-18-38)36-56(68-64)50-26-14-24-48-42-20-10-12-28-58(42)70-62(48)50;1-3-13-37(14-4-1)53-35-55(39-25-29-59-49(31-39)43-17-9-11-21-57(43)69-59)67-63(65-53)41-23-27-47-51(33-41)61-45-19-7-8-20-46(45)62(47)52-34-42(24-28-48(52)61)64-66-54(38-15-5-2-6-16-38)36-56(68-64)40-26-30-60-50(32-40)44-18-10-12-22-58(44)70-60;1-3-13-37(14-4-1)53-35-55(39-23-27-45-43-17-9-11-21-57(43)69-59(45)33-39)67-63(65-53)41-25-29-49-51(31-41)61-47-19-7-8-20-48(47)62(49)52-32-42(26-30-50(52)61)64-66-54(38-15-5-2-6-16-38)36-56(68-64)40-24-28-46-44-18-10-12-22-58(44)70-60(46)34-40/h1-44,71-72H;2*1-44,73-74H;1-36,59-60H;2*1-36,61-62H/t71-,72?;2*73-,74?;59-,60?;2*61-,62?/m111111/s1.
What are the key properties of 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine?
4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine has a molecular weight of 6019.61 g/mol, XLogP of 111.95, 42 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzothiophen-2-yl-2-[(1R)-11-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-3-yl-2-[(1R)-11-(4-dibenzothiophen-3-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-dibenzothiophen-4-yl-2-[(1R)-11-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-2-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-2-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-3-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-3-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine;4-(4-dibenzothiophen-4-ylphenyl)-2-[(1R)-11-[4-(4-dibenzothiophen-4-ylphenyl)-6-phenylpyrimidin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenylpyrimidine is sourced from PubChem (CID 167674696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).