2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole

C402H306N6 — CID 159539120

IUPAC2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole
SMILESCC(C)(C)C1CCC2(C)C(C1)c1cc(-c3cc(-c4cccc5ccccc45)c4ccc5c(-c6cccc7ccccc67)cc(-c6cccc7ccccc67)c6ccc3c4c65)ccc1N2c1ccccc1.CC1(C)CC2(C)c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C2(C)C1.CC1(C)CCC2c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C21C.CC1CCC2(C)c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C2(C)C1.CC1CCC2c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C12C.CCC1CCC2(C)N(c3ccccc3)c3ccc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)cc3C2(C)C1
InChIInChI=1S/C69H55N.C68H53N.2C67H51N.C66H49N.C65H47N/c1-68(2,3)47-37-38-69(4)64(40-47)63-39-46(31-36-65(63)70(69)48-23-6-5-7-24-48)59-41-60(52-28-14-20-43-17-8-11-25-49(43)52)56-34-35-58-62(54-30-16-22-45-19-10-13-27-51(45)54)42-61(57-33-32-55(59)66(56)67(57)58)53-29-15-21-44-18-9-12-26-50(44)53;1-4-43-37-38-68(3)67(2,42-43)63-39-47(31-36-64(63)69(68)48-23-6-5-7-24-48)59-40-60(52-28-14-20-44-17-8-11-25-49(44)52)56-34-35-58-62(54-30-16-22-46-19-10-13-27-51(46)54)41-61(57-33-32-55(59)65(56)66(57)58)53-29-15-21-45-18-9-12-26-50(45)53;1-65(2)40-66(3)61-37-45(31-36-62(61)68(67(66,4)41-65)46-23-6-5-7-24-46)57-38-58(50-28-14-20-42-17-8-11-25-47(42)50)54-34-35-56-60(52-30-16-22-44-19-10-13-27-49(44)52)39-59(55-33-32-53(57)63(54)64(55)56)51-29-15-21-43-18-9-12-26-48(43)51;1-42-36-37-66(2)62-38-46(30-35-63(62)68(67(66,3)41-42)47-22-5-4-6-23-47)58-39-59(51-27-13-19-43-16-7-10-24-48(43)51)55-33-34-57-61(53-29-15-21-45-18-9-12-26-50(45)53)40-60(56-32-31-54(58)64(55)65(56)57)52-28-14-20-44-17-8-11-25-49(44)52;1-65(2)37-36-61-60-38-44(30-35-62(60)67(66(61,65)3)45-22-5-4-6-23-45)56-39-57(49-27-13-19-41-16-7-10-24-46(41)49)53-33-34-55-59(51-29-15-21-43-18-9-12-26-48(43)51)40-58(54-32-31-52(56)63(53)64(54)55)50-28-14-20-42-17-8-11-25-47(42)50;1-40-29-35-61-60-37-44(30-36-62(60)66(65(40,61)2)45-21-4-3-5-22-45)56-38-57(49-26-12-18-41-15-6-9-23-46(41)49)53-33-34-55-59(51-28-14-20-43-17-8-11-25-48(43)51)39-58(54-32-31-52(56)63(53)64(54)55)50-27-13-19-42-16-7-10-24-47(42)50/h5-36,39,41-42,47,64H,37-38,40H2,1-4H3;5-36,39-41,43H,4,37-38,42H2,1-3H3;5-39H,40-41H2,1-4H3;4-35,38-40,42H,36-37,41H2,1-3H3;4-35,38-40,61H,36-37H2,1-3H3;3-28,30-34,36-40,61H,29,35H2,1-2H3
InChIKeyMDYWGHVBZCQPLQ-UHFFFAOYSA-N
MW5220.91 g/mol
LogP112.70
Rot. Bonds31

About 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole

2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole (PubChem CID 159539120) has the molecular formula C402H306N6 and a molecular weight of 5220.91 g/mol. Its IUPAC name is 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole.

Molecular Properties

Compound Name2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole
PubChem CID159539120
Molecular FormulaC402H306N6
Molecular Weight5220.91 g/mol
Exact Mass5216.41
IUPAC Name2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole
SMILESCC(C)(C)C1CCC2(C)C(C1)c1cc(-c3cc(-c4cccc5ccccc45)c4ccc5c(-c6cccc7ccccc67)cc(-c6cccc7ccccc67)c6ccc3c4c65)ccc1N2c1ccccc1.CC1(C)CC2(C)c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C2(C)C1.CC1(C)CCC2c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C21C.CC1CCC2(C)c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C2(C)C1.CC1CCC2c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C12C.CCC1CCC2(C)N(c3ccccc3)c3ccc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)cc3C2(C)C1
InChIInChI=1S/C69H55N.C68H53N.2C67H51N.C66H49N.C65H47N/c1-68(2,3)47-37-38-69(4)64(40-47)63-39-46(31-36-65(63)70(69)48-23-6-5-7-24-48)59-41-60(52-28-14-20-43-17-8-11-25-49(43)52)56-34-35-58-62(54-30-16-22-45-19-10-13-27-51(45)54)42-61(57-33-32-55(59)66(56)67(57)58)53-29-15-21-44-18-9-12-26-50(44)53;1-4-43-37-38-68(3)67(2,42-43)63-39-47(31-36-64(63)69(68)48-23-6-5-7-24-48)59-40-60(52-28-14-20-44-17-8-11-25-49(44)52)56-34-35-58-62(54-30-16-22-46-19-10-13-27-51(46)54)41-61(57-33-32-55(59)65(56)66(57)58)53-29-15-21-45-18-9-12-26-50(45)53;1-65(2)40-66(3)61-37-45(31-36-62(61)68(67(66,4)41-65)46-23-6-5-7-24-46)57-38-58(50-28-14-20-42-17-8-11-25-47(42)50)54-34-35-56-60(52-30-16-22-44-19-10-13-27-49(44)52)39-59(55-33-32-53(57)63(54)64(55)56)51-29-15-21-43-18-9-12-26-48(43)51;1-42-36-37-66(2)62-38-46(30-35-63(62)68(67(66,3)41-42)47-22-5-4-6-23-47)58-39-59(51-27-13-19-43-16-7-10-24-48(43)51)55-33-34-57-61(53-29-15-21-45-18-9-12-26-50(45)53)40-60(56-32-31-54(58)64(55)65(56)57)52-28-14-20-44-17-8-11-25-49(44)52;1-65(2)37-36-61-60-38-44(30-35-62(60)67(66(61,65)3)45-22-5-4-6-23-45)56-39-57(49-27-13-19-41-16-7-10-24-46(41)49)53-33-34-55-59(51-29-15-21-43-18-9-12-26-48(43)51)40-58(54-32-31-52(56)63(53)64(54)55)50-28-14-20-42-17-8-11-25-47(42)50;1-40-29-35-61-60-37-44(30-36-62(60)66(65(40,61)2)45-21-4-3-5-22-45)56-38-57(49-26-12-18-41-15-6-9-23-46(41)49)53-33-34-55-59(51-28-14-20-43-17-8-11-25-48(43)51)39-58(54-32-31-52(56)63(53)64(54)55)50-27-13-19-42-16-7-10-24-47(42)50/h5-36,39,41-42,47,64H,37-38,40H2,1-4H3;5-36,39-41,43H,4,37-38,42H2,1-3H3;5-39H,40-41H2,1-4H3;4-35,38-40,42H,36-37,41H2,1-3H3;4-35,38-40,61H,36-37H2,1-3H3;3-28,30-34,36-40,61H,29,35H2,1-2H3
InChIKeyMDYWGHVBZCQPLQ-UHFFFAOYSA-N
XLogP112.70
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds31
Heavy Atoms408
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5005220.91
LogP ≤ 5112.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole with MolForge

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Related Compounds

9a-tert-butyl-6-(9,9-diphenylfluoren-2-yl)-4a-methyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;3-tert-butyl-6-(9,9-diphenylfluoren-2-yl)-9a-methyl-9-phenyl-2,3,4,4a-tetrahydro-1H-carbazole;6-(9,9-diphenylfluoren-2-yl)-2,4a,9a-trimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;7-(9,9-diphenylfluoren-2-yl)-2,2,3a,8b-tetramethyl-4-phenyl-1,3-dihydrocyclopenta[b]indole;7-(9,9-diphenylfluoren-2-yl)-1,3a-dimethyl-4-phenyl-1,2,3,8b-tetrahydrocyclopenta[b]indole;7-(9,9-diphenylfluoren-2-yl)-3,3a-dimethyl-4-phenyl-1,2,3,8b-tetrahydrocyclopenta[b]indole;7-(9,9-diphenylfluoren-2-yl)-3,3,3a-trimethyl-4-phenyl-2,8b-dihydro-1H-cyclopenta[b]indole;6-(9,9-diphenylfluoren-2-yl)-3-ethyl-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole
CID 159852359
7-[5-(2,2,3a,8b-tetramethyl-4-phenyl-1,3-dihydrocyclopenta[b]indol-7-yl)-21,21-dimethyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-2,2,3a,8b-tetramethyl-4-phenyl-1,3-dihydrocyclopenta[b]indole;7-[5-(3,3a-dimethyl-4-phenyl-1,2,3,8b-tetrahydrocyclopenta[b]indol-7-yl)-21,21-dimethyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-3,3a-dimethyl-4-phenyl-1,2,3,8b-tetrahydrocyclopenta[b]indole;7-[5-(3,3,3a-trimethyl-4-phenyl-2,8b-dihydro-1H-cyclopenta[b]indol-7-yl)-21,21-dimethyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-3,3,3a-trimethyl-4-phenyl-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-6-[5-(6-tert-butyl-8a-methyl-9-phenyl-5,6,7,8-tetrahydro-4bH-carbazol-3-yl)-21,21-dimethyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-9a-methyl-9-phenyl-2,3,4,4a-tetrahydro-1H-carbazole
CID 161288613
2,4a,9a-trimethyl-6-(6-naphthalen-1-ylpyren-1-yl)-9-phenyl-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-7-(6-naphthalen-1-ylpyren-1-yl)-4-phenyl-1,3-dihydrocyclopenta[b][1]benzoborole;9a-tert-butyl-4a-methyl-6-(6-naphthalen-1-ylpyren-1-yl)-9-phenyl-1,2,3,4-tetrahydrocarbazole;3,9a-dimethyl-6-(6-naphthalen-1-ylpyren-1-yl)-9-phenyl-2,3,4,4a-tetrahydro-1H-carbazole;4,9a-dimethyl-6-(6-naphthalen-1-ylpyren-1-yl)-9-phenyl-2,3,4,4a-tetrahydro-1H-carbazole;3,3,3a-trimethyl-7-(6-naphthalen-1-ylpyren-1-yl)-4-phenyl-2,8b-dihydro-1H-cyclopenta[b][1]benzoborole;8-tert-butyl-5a-methyl-2-(6-naphthalen-1-ylpyren-1-yl)-5-phenyl-7,8,9,9a-tetrahydro-6H-benzo[b][1]benzoborole;3-ethyl-4a,9a-dimethyl-6-(6-naphthalen-1-ylpyren-1-yl)-9-phenyl-1,2,3,4-tetrahydrocarbazole
CID 159284811
6-[3,6-bis[4b,8a-dimethyl-9-(2,3,4,5,6-pentafluorophenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-8-naphthalen-1-ylpyren-1-yl]-4a,9a-dimethyl-9-(2,3,4,5,6-pentafluorophenyl)-1,2,3,4-tetrahydrocarbazole;6-[3,6-bis[9-(4-tert-butylphenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-8-naphthalen-1-ylpyren-1-yl]-9-(4-tert-butylphenyl)-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole;4-[6-[3,8-bis[9-[4-(dimethylamino)phenyl]-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-6-naphthalen-1-ylpyren-1-yl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]-N,N-dimethylaniline
CID 159081456
6-[5-[3,6-bis[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)naphthalen-1-yl]-8-naphthalen-1-ylpyren-1-yl]naphthalen-1-yl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-[3,6-bis(1,2,4b,8a-tetramethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-8-naphthalen-1-ylpyren-1-yl]-4a,7,8,9a-tetramethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-[3,6-bis(1,4,4b,8a-tetramethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-8-naphthalen-1-ylpyren-1-yl]-4a,5,8,9a-tetramethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-[3,6-bis(1,4b,8a-trimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-8-naphthalen-1-ylpyren-1-yl]-4a,8,9a-trimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole
CID 158318887
4a,9a-dimethyl-9-naphthalen-1-yl-6-[10,20,22-tris(4b,8a-dimethyl-9-naphthalen-1-yl-5,6,7,8-tetrahydrocarbazol-3-yl)-8-heptacyclo[15.7.1.15,9.02,16.04,14.021,25.013,26]hexacosa-1(25),2(16),3,5(26),6,8,10,12,14,17,19,21,23-tridecaenyl]-1,2,3,4-tetrahydrocarbazole;9-(4-tert-butylphenyl)-4a,9a-dimethyl-6-[10,20,22-tris[9-(4-tert-butylphenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-8-heptacyclo[15.7.1.15,9.02,16.04,14.021,25.013,26]hexacosa-1(25),2(16),3,5(26),6,8,10,12,14,17,19,21,23-tridecaenyl]-1,2,3,4-tetrahydrocarbazole
CID 160666768
1,6-bis(4-tert-butylphenyl)-3,8-bis(4-naphthalen-1-ylphenyl)pyrene
CID 59391221
3,3,3a-trimethyl-7-(6-naphthalen-1-ylpyren-1-yl)-4-phenyl-2,8b-dihydro-1H-cyclopenta[b][1]benzoborole
CID 140611499
N-[4-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N,N-bis(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-5-naphthalen-1-ylfluoreno[4,3-b][1]benzofuran-1-amine;N-[4-[7,7-dimethyl-5-(4-naphthalen-1-ylphenyl)fluoreno[4,3-b][1]benzofuran-1-yl]phenyl]-N,4-diphenylaniline
CID 159910131
6-(3,8-diphenylpyren-1-yl)-4a,5,8,9a-tetramethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-(3,8-diphenylpyren-1-yl)-4a,7,8,9a-tetramethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-(3,8-diphenylpyren-1-yl)-4a,7,9a-trimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-(3,8-diphenylpyren-1-yl)-4a,8,9a-trimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-(3,8-diphenylpyren-1-yl)-9a-methyl-4a-methylsulfanyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;6-[4-(3,8-diphenylpyren-1-yl)phenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole
CID 161180933
1-(9,9-dimethyl-7-naphthalen-1-ylfluoren-2-yl)pyrene;1-naphthalen-1-yl-3,6-dinaphthalen-2-ylpyrene;3-naphthalen-1-yl-1,6-diphenylpyrene;3-naphthalen-2-yl-1,6-diphenylpyrene;5-naphthalen-1-yl-1-naphthalen-2-ylpyrene
CID 161018965
3-(4a,9a-dimethyl-6-phenyl-1,2,3,4-tetrahydrocarbazol-9-yl)-N,N-bis(4-tert-butylphenyl)-5-methylaniline
CID 166015021

Frequently Asked Questions

What is the IUPAC name of 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole?
The IUPAC name of 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole (CID 159539120) is 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole.
What is the SMILES notation for 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole?
The canonical SMILES for 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole is CC(C)(C)C1CCC2(C)C(C1)c1cc(-c3cc(-c4cccc5ccccc45)c4ccc5c(-c6cccc7ccccc67)cc(-c6cccc7ccccc67)c6ccc3c4c65)ccc1N2c1ccccc1.CC1(C)CC2(C)c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C2(C)C1.CC1(C)CCC2c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C21C.CC1CCC2(C)c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C2(C)C1.CC1CCC2c3cc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)ccc3N(c3ccccc3)C12C.CCC1CCC2(C)N(c3ccccc3)c3ccc(-c4cc(-c5cccc6ccccc56)c5ccc6c(-c7cccc8ccccc78)cc(-c7cccc8ccccc78)c7ccc4c5c76)cc3C2(C)C1.
What is the InChIKey of 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole?
The InChIKey is MDYWGHVBZCQPLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H55N.C68H53N.2C67H51N.C66H49N.C65H47N/c1-68(2,3)47-37-38-69(4)64(40-47)63-39-46(31-36-65(63)70(69)48-23-6-5-7-24-48)59-41-60(52-28-14-20-43-17-8-11-25-49(43)52)56-34-35-58-62(54-30-16-22-45-19-10-13-27-51(45)54)42-61(57-33-32-55(59)66(56)67(57)58)53-29-15-21-44-18-9-12-26-50(44)53;1-4-43-37-38-68(3)67(2,42-43)63-39-47(31-36-64(63)69(68)48-23-6-5-7-24-48)59-40-60(52-28-14-20-44-17-8-11-25-49(44)52)56-34-35-58-62(54-30-16-22-46-19-10-13-27-51(46)54)41-61(57-33-32-55(59)65(56)66(57)58)53-29-15-21-45-18-9-12-26-50(45)53;1-65(2)40-66(3)61-37-45(31-36-62(61)68(67(66,4)41-65)46-23-6-5-7-24-46)57-38-58(50-28-14-20-42-17-8-11-25-47(42)50)54-34-35-56-60(52-30-16-22-44-19-10-13-27-49(44)52)39-59(55-33-32-53(57)63(54)64(55)56)51-29-15-21-43-18-9-12-26-48(43)51;1-42-36-37-66(2)62-38-46(30-35-63(62)68(67(66,3)41-42)47-22-5-4-6-23-47)58-39-59(51-27-13-19-43-16-7-10-24-48(43)51)55-33-34-57-61(53-29-15-21-45-18-9-12-26-50(45)53)40-60(56-32-31-54(58)64(55)65(56)57)52-28-14-20-44-17-8-11-25-49(44)52;1-65(2)37-36-61-60-38-44(30-35-62(60)67(66(61,65)3)45-22-5-4-6-23-45)56-39-57(49-27-13-19-41-16-7-10-24-46(41)49)53-33-34-55-59(51-29-15-21-43-18-9-12-26-48(43)51)40-58(54-32-31-52(56)63(53)64(54)55)50-28-14-20-42-17-8-11-25-47(42)50;1-40-29-35-61-60-37-44(30-36-62(60)66(65(40,61)2)45-21-4-3-5-22-45)56-38-57(49-26-12-18-41-15-6-9-23-46(41)49)53-33-34-55-59(51-28-14-20-43-17-8-11-25-48(43)51)39-58(54-32-31-52(56)63(53)64(54)55)50-27-13-19-42-16-7-10-24-47(42)50/h5-36,39,41-42,47,64H,37-38,40H2,1-4H3;5-36,39-41,43H,4,37-38,42H2,1-3H3;5-39H,40-41H2,1-4H3;4-35,38-40,42H,36-37,41H2,1-3H3;4-35,38-40,61H,36-37H2,1-3H3;3-28,30-34,36-40,61H,29,35H2,1-2H3.
What are the key properties of 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole?
2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole has a molecular weight of 5220.91 g/mol, XLogP of 112.70, 31 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4a,9a-trimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole;2,2,3a,8b-tetramethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,3-dihydrocyclopenta[b]indole;3,3a-dimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,8b-tetrahydrocyclopenta[b]indole;3,3,3a-trimethyl-4-phenyl-7-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,8b-dihydro-1H-cyclopenta[b]indole;3-tert-butyl-9a-methyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-2,3,4,4a-tetrahydro-1H-carbazole;3-ethyl-4a,9a-dimethyl-9-phenyl-6-(3,6,8-trinaphthalen-1-ylpyren-1-yl)-1,2,3,4-tetrahydrocarbazole is sourced from PubChem (CID 159539120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).