11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene

C314H184O2S12 — CID 164951993

IUPAC11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
SMILESCC(C)(C)c1ccc2c(-c3cc4ccc5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc3c(-c3ccccc3)c2c1.CCc1c2ccccc2cc2c1ccc1c(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cccc12.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc3c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc4c(-c4ccccc4)c3c2)cc1.c1ccc2c(c1)ccc1c(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cc3ccccc3c12.c1ccc2c(c1)oc1ccc3cc(-c4c5ccccc5c(-c5cc6ccc7sc8ccccc8c7c6c6c5sc5ccccc56)c5ccccc45)c4oc5ccccc5c4c3c12
InChIInChI=1S/C58H30O2S2.C56H34S2.C54H30S2.C52H30S2.C48H28S2.C46H32S2/c1-3-15-35-33(13-1)51(41-29-31-25-27-45-53(37-17-5-9-21-43(37)59-45)49(31)55-38-18-6-10-22-44(38)60-57(41)55)34-14-2-4-16-36(34)52(35)42-30-32-26-28-48-54(39-19-7-11-23-46(39)61-48)50(32)56-40-20-8-12-24-47(40)62-58(42)56;1-2-34-35-15-4-3-14-32(35)30-46-36-22-13-23-39(38(36)28-27-37(34)46)52-40-16-5-7-18-42(40)53(43-19-8-6-17-41(43)52)47-31-33-26-29-50-54(44-20-9-11-24-48(44)57-50)51(33)55-45-21-10-12-25-49(45)58-56(47)55;1-3-15-34-31(13-1)25-27-40-43(29-32-14-2-4-16-35(32)49(34)40)50-36-17-5-7-19-38(36)51(39-20-8-6-18-37(39)50)44-30-33-26-28-47-52(41-21-9-11-23-45(41)55-47)48(33)53-42-22-10-12-24-46(42)56-54(44)53;1-2-14-31(15-3-1)33-27-28-40(35-17-5-4-16-34(33)35)48-36-18-6-8-20-38(36)49(39-21-9-7-19-37(39)48)43-30-32-26-29-46-50(41-22-10-12-24-44(41)53-46)47(32)51-42-23-11-13-25-45(42)54-52(43)51;1-3-13-29(14-4-1)31-23-25-35-38(27-31)43(30-15-5-2-6-16-30)33-17-7-8-18-34(33)45(35)39-28-32-24-26-42-46(36-19-9-11-21-40(36)49-42)44(32)47-37-20-10-12-22-41(37)50-48(39)47;1-46(2,3)29-22-23-32-35(26-29)40(27-13-5-4-6-14-27)30-15-7-8-16-31(30)42(32)36-25-28-21-24-39-43(33-17-9-11-19-37(33)47-39)41(28)44-34-18-10-12-20-38(34)48-45(36)44/h1-30H;3-31H,2H2,1H3;1-30H;1-30H;1-28H;4-26H,1-3H3
InChIKeyAQRUNCRKEZVWCZ-UHFFFAOYSA-N
MW4373.73 g/mol
LogP97.51
Rot. Bonds15

About 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene

11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene (PubChem CID 164951993) has the molecular formula C314H184O2S12 and a molecular weight of 4373.73 g/mol. Its IUPAC name is 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene.

Molecular Properties

Compound Name11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
PubChem CID164951993
Molecular FormulaC314H184O2S12
Molecular Weight4373.73 g/mol
Exact Mass4369.09
IUPAC Name11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
SMILESCC(C)(C)c1ccc2c(-c3cc4ccc5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc3c(-c3ccccc3)c2c1.CCc1c2ccccc2cc2c1ccc1c(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cccc12.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc3c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc4c(-c4ccccc4)c3c2)cc1.c1ccc2c(c1)ccc1c(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cc3ccccc3c12.c1ccc2c(c1)oc1ccc3cc(-c4c5ccccc5c(-c5cc6ccc7sc8ccccc8c7c6c6c5sc5ccccc56)c5ccccc45)c4oc5ccccc5c4c3c12
InChIInChI=1S/C58H30O2S2.C56H34S2.C54H30S2.C52H30S2.C48H28S2.C46H32S2/c1-3-15-35-33(13-1)51(41-29-31-25-27-45-53(37-17-5-9-21-43(37)59-45)49(31)55-38-18-6-10-22-44(38)60-57(41)55)34-14-2-4-16-36(34)52(35)42-30-32-26-28-48-54(39-19-7-11-23-46(39)61-48)50(32)56-40-20-8-12-24-47(40)62-58(42)56;1-2-34-35-15-4-3-14-32(35)30-46-36-22-13-23-39(38(36)28-27-37(34)46)52-40-16-5-7-18-42(40)53(43-19-8-6-17-41(43)52)47-31-33-26-29-50-54(44-20-9-11-24-48(44)57-50)51(33)55-45-21-10-12-25-49(45)58-56(47)55;1-3-15-34-31(13-1)25-27-40-43(29-32-14-2-4-16-35(32)49(34)40)50-36-17-5-7-19-38(36)51(39-20-8-6-18-37(39)50)44-30-33-26-28-47-52(41-21-9-11-23-45(41)55-47)48(33)53-42-22-10-12-24-46(42)56-54(44)53;1-2-14-31(15-3-1)33-27-28-40(35-17-5-4-16-34(33)35)48-36-18-6-8-20-38(36)49(39-21-9-7-19-37(39)48)43-30-32-26-29-46-50(41-22-10-12-24-44(41)53-46)47(32)51-42-23-11-13-25-45(42)54-52(43)51;1-3-13-29(14-4-1)31-23-25-35-38(27-31)43(30-15-5-2-6-16-30)33-17-7-8-18-34(33)45(35)39-28-32-24-26-42-46(36-19-9-11-21-40(36)49-42)44(32)47-37-20-10-12-22-41(37)50-48(39)47;1-46(2,3)29-22-23-32-35(26-29)40(27-13-5-4-6-14-27)30-15-7-8-16-31(30)42(32)36-25-28-21-24-39-43(33-17-9-11-19-37(33)47-39)41(28)44-34-18-10-12-20-38(34)48-45(36)44/h1-30H;3-31H,2H2,1H3;1-30H;1-30H;1-28H;4-26H,1-3H3
InChIKeyAQRUNCRKEZVWCZ-UHFFFAOYSA-N
XLogP97.51
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds15
Heavy Atoms328
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004373.73
LogP ≤ 597.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene with MolForge

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Related Compounds

11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
CID 164818072
11-deuterio-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-phenyl-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;14-phenyl-11-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
CID 165109517
11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene
CID 164974984
9,10-bis(4-phenylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-(4-phenylphenyl)anthracene;1-[4-(10-phenanthren-9-ylanthracen-9-yl)phenyl]dibenzofuran;1-[4-(10-phenanthren-9-ylanthracen-9-yl)phenyl]dibenzothiophene;9-(2-phenylphenyl)-10-(4-phenylphenyl)anthracene;9-(3-phenylphenyl)-10-(4-phenylphenyl)anthracene
CID 164981565
18-[4-[10-(3-phenylphenyl)anthracen-9-yl]naphthalen-1-yl]-14-oxa-9-thiahexacyclo[11.11.0.02,10.03,8.015,24.016,21]tetracosa-1(13),2(10),3,5,7,11,15(24),16(21),17,19,22-undecaene
CID 130185842
11-(10-benzo[a]anthracen-4-ylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(3,5-diphenylphenyl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(3-methylphenyl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-methylphenyl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(10-phenanthren-1-ylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(10-phenanthren-3-ylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylphenyl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
CID 164953678
1-[9,10-bis(3-phenylphenyl)anthracen-2-yl]dibenzofuran;1-[9,10-bis(4-phenylphenyl)anthracen-2-yl]dibenzofuran;1-[9,10-bis(4-phenylphenyl)anthracen-2-yl]dibenzothiophene;1-(9,10-diphenylanthracen-2-yl)dibenzofuran;1-(9,10-diphenylanthracen-2-yl)dibenzothiophene;2-naphthalen-1-yl-10-(2-phenylphenyl)-9-(4-phenylphenyl)anthracene;2-phenyl-9,10-bis(2-phenylphenyl)anthracene;1-[10-(2-phenylphenyl)-9-(3-phenylphenyl)anthracen-2-yl]dibenzofuran;1-[10-(3-phenylphenyl)-9-(4-phenylphenyl)anthracen-2-yl]dibenzofuran
CID 162247966
2-[4-(10-phenanthren-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[4-(10-phenanthren-2-ylanthracen-9-yl)phenyl]dibenzofuran;2-[4-(10-phenanthren-2-ylanthracen-9-yl)phenyl]dibenzothiophene;9-phenanthren-4-yl-10-(3-phenanthren-9-ylphenyl)anthracene;9-phenanthren-4-yl-10-(3-phenylphenyl)anthracene
CID 160988398
6-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9-oxa-14-thiahexacyclo[11.11.0.02,10.03,8.015,24.016,21]tetracosa-1(13),2(10),3(8),4,6,11,15(24),16,18,20,22-undecaene
CID 130190479
11-(2-naphthalen-2-yl-10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
CID 164818022
11-(10-phenanthren-3-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
CID 164818101
18-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]-14-oxa-9-thiahexacyclo[11.11.0.02,10.03,8.015,24.016,21]tetracosa-1(13),2(10),3,5,7,11,15(24),16(21),17,19,22-undecaene
CID 130185790

Frequently Asked Questions

What is the IUPAC name of 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene?
The IUPAC name of 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene (CID 164951993) is 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene.
What is the SMILES notation for 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene?
The canonical SMILES for 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene is CC(C)(C)c1ccc2c(-c3cc4ccc5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc3c(-c3ccccc3)c2c1.CCc1c2ccccc2cc2c1ccc1c(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cccc12.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc3c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc4c(-c4ccccc4)c3c2)cc1.c1ccc2c(c1)ccc1c(-c3c4ccccc4c(-c4cc5ccc6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cc3ccccc3c12.c1ccc2c(c1)oc1ccc3cc(-c4c5ccccc5c(-c5cc6ccc7sc8ccccc8c7c6c6c5sc5ccccc56)c5ccccc45)c4oc5ccccc5c4c3c12.
What is the InChIKey of 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene?
The InChIKey is AQRUNCRKEZVWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H30O2S2.C56H34S2.C54H30S2.C52H30S2.C48H28S2.C46H32S2/c1-3-15-35-33(13-1)51(41-29-31-25-27-45-53(37-17-5-9-21-43(37)59-45)49(31)55-38-18-6-10-22-44(38)60-57(41)55)34-14-2-4-16-36(34)52(35)42-30-32-26-28-48-54(39-19-7-11-23-46(39)61-48)50(32)56-40-20-8-12-24-47(40)62-58(42)56;1-2-34-35-15-4-3-14-32(35)30-46-36-22-13-23-39(38(36)28-27-37(34)46)52-40-16-5-7-18-42(40)53(43-19-8-6-17-41(43)52)47-31-33-26-29-50-54(44-20-9-11-24-48(44)57-50)51(33)55-45-21-10-12-25-49(45)58-56(47)55;1-3-15-34-31(13-1)25-27-40-43(29-32-14-2-4-16-35(32)49(34)40)50-36-17-5-7-19-38(36)51(39-20-8-6-18-37(39)50)44-30-33-26-28-47-52(41-21-9-11-23-45(41)55-47)48(33)53-42-22-10-12-24-46(42)56-54(44)53;1-2-14-31(15-3-1)33-27-28-40(35-17-5-4-16-34(33)35)48-36-18-6-8-20-38(36)49(39-21-9-7-19-37(39)48)43-30-32-26-29-46-50(41-22-10-12-24-44(41)53-46)47(32)51-42-23-11-13-25-45(42)54-52(43)51;1-3-13-29(14-4-1)31-23-25-35-38(27-31)43(30-15-5-2-6-16-30)33-17-7-8-18-34(33)45(35)39-28-32-24-26-42-46(36-19-9-11-21-40(36)49-42)44(32)47-37-20-10-12-22-41(37)50-48(39)47;1-46(2,3)29-22-23-32-35(26-29)40(27-13-5-4-6-14-27)30-15-7-8-16-31(30)42(32)36-25-28-21-24-39-43(33-17-9-11-19-37(33)47-39)41(28)44-34-18-10-12-20-38(34)48-45(36)44/h1-30H;3-31H,2H2,1H3;1-30H;1-30H;1-28H;4-26H,1-3H3.
What are the key properties of 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene?
11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene has a molecular weight of 4373.73 g/mol, XLogP of 97.51, 15 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(10-benzo[c]phenanthren-6-ylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3-tert-butyl-10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-(3,10-diphenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaen-11-yl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(7-ethylbenzo[a]anthracen-4-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene;11-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene is sourced from PubChem (CID 164951993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).