11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene

C295H223N13 — CID 157475875

IUPAC11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene
SMILESCC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccc(-n2c4ccccc4c4ccccc42)cc1-c1ccccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1cccc(-n2c4ccccc4c4ccccc42)c1-c1ccccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1cccc2c1-c1c-3cccc1C2(n1c2ccccc2c2ccccc21)n1c2ccccc2c2ccccc21.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1c-3cccc1-n1c2ccccc2c2ccccc21.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1cc(-n2c4ccccc4c4ccccc42)ccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1ccc(-n2c4ccccc4c4ccccc42)cc1-3
InChIInChI=1S/C60H43N3.5C47H36N2/c1-59(2)34-35-61(38-18-4-3-5-19-38)56-37-48-46-27-17-29-50-58(46)57-45(39-20-6-7-21-40(39)47(48)36-51(56)59)26-16-28-49(57)60(50,62-52-30-12-8-22-41(52)42-23-9-13-31-53(42)62)63-54-32-14-10-24-43(54)44-25-11-15-33-55(44)63;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-37-25-24-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)28-40(37)35-18-8-6-16-33(35)34-17-7-9-19-36(34)41(42)29-43(46)47;1-47(2)27-28-48(31-15-4-3-5-16-31)45-30-40-38-23-14-26-44(49-42-24-12-10-20-35(42)36-21-11-13-25-43(36)49)46(38)37-22-9-8-18-33(37)32-17-6-7-19-34(32)39(40)29-41(45)47;1-47(2)27-28-48(31-15-4-3-5-16-31)45-30-40-34-19-8-9-22-37(34)46-38(32-17-6-7-18-33(32)39(40)29-41(45)47)23-14-26-44(46)49-42-24-12-10-20-35(42)36-21-11-13-25-43(36)49;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-40-28-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)24-25-37(40)35-18-7-6-16-33(35)34-17-8-9-19-36(34)41(42)29-43(46)47;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-36-19-9-8-18-35(36)40-28-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)24-25-37(40)33-16-6-7-17-34(33)41(42)29-43(46)47/h3-33,36-37H,34-35H2,1-2H3;3-25,28-30H,26-27H2,1-2H3;2*3-26,29-30H,27-28H2,1-2H3;2*3-25,28-30H,26-27H2,1-2H3/b45-39-,47-40-,48-46-;34-33-,40-35-,41-36-,42-37-;33-32-,39-34-,40-38-,46-37+;38-32-,39-33-,40-34-,46-37+;34-33-,37-35-,41-36-,42-40-;37-33-,40-35-,41-34-,42-36-
InChIKeyBVOWSFJXNALEEQ-PSTHOMIWSA-N
MW3950.12 g/mol
LogP78.24
Rot. Bonds13

About 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene

11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene (PubChem CID 157475875) has the molecular formula C295H223N13 and a molecular weight of 3950.12 g/mol. Its IUPAC name is 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene.

Molecular Properties

Compound Name11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene
PubChem CID157475875
Molecular FormulaC295H223N13
Molecular Weight3950.12 g/mol
Exact Mass3946.78
IUPAC Name11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene
SMILESCC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccc(-n2c4ccccc4c4ccccc42)cc1-c1ccccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1cccc(-n2c4ccccc4c4ccccc42)c1-c1ccccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1cccc2c1-c1c-3cccc1C2(n1c2ccccc2c2ccccc21)n1c2ccccc2c2ccccc21.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1c-3cccc1-n1c2ccccc2c2ccccc21.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1cc(-n2c4ccccc4c4ccccc42)ccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1ccc(-n2c4ccccc4c4ccccc42)cc1-3
InChIInChI=1S/C60H43N3.5C47H36N2/c1-59(2)34-35-61(38-18-4-3-5-19-38)56-37-48-46-27-17-29-50-58(46)57-45(39-20-6-7-21-40(39)47(48)36-51(56)59)26-16-28-49(57)60(50,62-52-30-12-8-22-41(52)42-23-9-13-31-53(42)62)63-54-32-14-10-24-43(54)44-25-11-15-33-55(44)63;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-37-25-24-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)28-40(37)35-18-8-6-16-33(35)34-17-7-9-19-36(34)41(42)29-43(46)47;1-47(2)27-28-48(31-15-4-3-5-16-31)45-30-40-38-23-14-26-44(49-42-24-12-10-20-35(42)36-21-11-13-25-43(36)49)46(38)37-22-9-8-18-33(37)32-17-6-7-19-34(32)39(40)29-41(45)47;1-47(2)27-28-48(31-15-4-3-5-16-31)45-30-40-34-19-8-9-22-37(34)46-38(32-17-6-7-18-33(32)39(40)29-41(45)47)23-14-26-44(46)49-42-24-12-10-20-35(42)36-21-11-13-25-43(36)49;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-40-28-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)24-25-37(40)35-18-7-6-16-33(35)34-17-8-9-19-36(34)41(42)29-43(46)47;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-36-19-9-8-18-35(36)40-28-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)24-25-37(40)33-16-6-7-17-34(33)41(42)29-43(46)47/h3-33,36-37H,34-35H2,1-2H3;3-25,28-30H,26-27H2,1-2H3;2*3-26,29-30H,27-28H2,1-2H3;2*3-25,28-30H,26-27H2,1-2H3/b45-39-,47-40-,48-46-;34-33-,40-35-,41-36-,42-37-;33-32-,39-34-,40-38-,46-37+;38-32-,39-33-,40-34-,46-37+;34-33-,37-35-,41-36-,42-40-;37-33-,40-35-,41-34-,42-36-
InChIKeyBVOWSFJXNALEEQ-PSTHOMIWSA-N
XLogP78.24
TPSA53.95 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds13
Heavy Atoms308
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003950.12
LogP ≤ 578.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene with MolForge

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Launch Full Analysis

Related Compounds

11,16-di(carbazol-9-yl)-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14(19),15,17,20,22(27)-dodecaene
CID 134428174
11,16-di(carbazol-9-yl)-26,26-dimethyl-23-phenyl-3,23-diazahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2(7),3,5,8(13),9,11,14(19),15,17,20,22(27)-dodecaene
CID 134428222
16-carbazol-9-yl-26,26-dimethyl-23-phenyl-3,23-diazahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2(7),3,5,8,10,12,14(19),15,17,20,22(27)-dodecaene
CID 134428228
6,9-bis(3-carbazol-9-ylcarbazol-9-yl)-23,26-diphenyl-23,26-diazahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2(7),3,5,8(13),9,11,14,16,18,20,22(27)-dodecaene
CID 134428145
33,33-di(carbazol-9-yl)-16,16-dimethyl-9-phenyl-9-azaoctacyclo[28.2.1.05,32.06,19.08,17.010,15.020,25.026,31]tritriaconta-1,3,5(32),6,8(17),10,12,14,18,20,22,24,26(31),27,29-pentadecaene
CID 134428389
9-(4-carbazol-9-yl-9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(6-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2(7),3,5,8,10,12,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(9-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole;9-(10-octacyclo[18.16.0.02,7.08,13.014,19.022,35.023,28.029,34]hexatriaconta-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27,29,31,33,35-octadecaenyl)carbazole
CID 162230175
17-carbazol-9-yl-30,30-dimethyl-23-phenyl-23-azaheptacyclo[18.12.0.02,7.08,13.014,19.022,31.024,29]dotriaconta-1(32),2,4,6,8,10,12,14(19),15,17,20,22(31),24,26,28-pentadecaene
CID 134428385
12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27),24-tridecaene
CID 134428282
5,10-di(carbazol-9-yl)-26-phenyl-23-oxa-26-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2(7),3,5,8(13),9,11,14,16,18,20,22(27)-dodecaene
CID 134428162
6-carbazol-9-yl-25-azahexacyclo[18.8.0.02,7.08,13.014,19.021,26]octacosa-1(20),2(7),3,5,8,10,12,14,16,18,21(26),22,24,27-tetradecaene;9-carbazol-9-yl-25-azahexacyclo[18.8.0.02,7.08,13.014,19.021,26]octacosa-1(20),2,4,6,8(13),9,11,14,16,18,21(26),22,24,27-tetradecaene;10-carbazol-9-yl-25-azahexacyclo[18.8.0.02,7.08,13.014,19.021,26]octacosa-1(20),2,4,6,8(13),9,11,14,16,18,21(26),22,24,27-tetradecaene;11-carbazol-9-yl-25-azahexacyclo[18.8.0.02,7.08,13.014,19.021,26]octacosa-1(20),2,4,6,8(13),9,11,14,16,18,21(26),22,24,27-tetradecaene
CID 159039559
12,15-di(carbazol-9-yl)-23,26-diphenyl-3,23,26-triazahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2(7),3,5,8(13),9,11,14(19),15,17,20,22(27)-dodecaene
CID 134428197
3-carbazol-9-yl-9-(6-carbazol-9-yltetraphenylen-2-yl)carbazole
CID 168811183

Frequently Asked Questions

What is the IUPAC name of 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene?
The IUPAC name of 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene (CID 157475875) is 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene.
What is the SMILES notation for 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene?
The canonical SMILES for 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene is CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccc(-n2c4ccccc4c4ccccc42)cc1-c1ccccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1cccc(-n2c4ccccc4c4ccccc42)c1-c1ccccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1cccc2c1-c1c-3cccc1C2(n1c2ccccc2c2ccccc21)n1c2ccccc2c2ccccc21.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1c-3cccc1-n1c2ccccc2c2ccccc21.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1cc(-n2c4ccccc4c4ccccc42)ccc1-3.CC1(C)CCN(c2ccccc2)c2cc3c(cc21)-c1ccccc1-c1ccccc1-c1ccc(-n2c4ccccc4c4ccccc42)cc1-3.
What is the InChIKey of 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene?
The InChIKey is BVOWSFJXNALEEQ-PSTHOMIWSA-N. The full InChI is InChI=1S/C60H43N3.5C47H36N2/c1-59(2)34-35-61(38-18-4-3-5-19-38)56-37-48-46-27-17-29-50-58(46)57-45(39-20-6-7-21-40(39)47(48)36-51(56)59)26-16-28-49(57)60(50,62-52-30-12-8-22-41(52)42-23-9-13-31-53(42)62)63-54-32-14-10-24-43(54)44-25-11-15-33-55(44)63;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-37-25-24-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)28-40(37)35-18-8-6-16-33(35)34-17-7-9-19-36(34)41(42)29-43(46)47;1-47(2)27-28-48(31-15-4-3-5-16-31)45-30-40-38-23-14-26-44(49-42-24-12-10-20-35(42)36-21-11-13-25-43(36)49)46(38)37-22-9-8-18-33(37)32-17-6-7-19-34(32)39(40)29-41(45)47;1-47(2)27-28-48(31-15-4-3-5-16-31)45-30-40-34-19-8-9-22-37(34)46-38(32-17-6-7-18-33(32)39(40)29-41(45)47)23-14-26-44(46)49-42-24-12-10-20-35(42)36-21-11-13-25-43(36)49;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-40-28-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)24-25-37(40)35-18-7-6-16-33(35)34-17-8-9-19-36(34)41(42)29-43(46)47;1-47(2)26-27-48(31-14-4-3-5-15-31)46-30-42-36-19-9-8-18-35(36)40-28-32(49-44-22-12-10-20-38(44)39-21-11-13-23-45(39)49)24-25-37(40)33-16-6-7-17-34(33)41(42)29-43(46)47/h3-33,36-37H,34-35H2,1-2H3;3-25,28-30H,26-27H2,1-2H3;2*3-26,29-30H,27-28H2,1-2H3;2*3-25,28-30H,26-27H2,1-2H3/b45-39-,47-40-,48-46-;34-33-,40-35-,41-36-,42-37-;33-32-,39-34-,40-38-,46-37+;38-32-,39-33-,40-34-,46-37+;34-33-,37-35-,41-36-,42-40-;37-33-,40-35-,41-34-,42-36-.
What are the key properties of 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene?
11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene has a molecular weight of 3950.12 g/mol, XLogP of 78.24, 13 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 11-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;12-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8(13),9,11,14,16,18,20,22(27)-dodecaene;15-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;16-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;17-carbazol-9-yl-26,26-dimethyl-23-phenyl-23-azahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(28),2,4,6,8,10,12,14(19),15,17,20,22(27)-dodecaene;29,29-di(carbazol-9-yl)-12,12-dimethyl-9-phenyl-9-azaheptacyclo[24.2.1.05,28.06,15.08,13.016,21.022,27]nonacosa-1,3,5(28),6,8(13),14,16,18,20,22(27),23,25-dodecaene is sourced from PubChem (CID 157475875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).