2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene

C143H93N3S — CID 159475348

IUPAC2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene
SMILESCC1(C)c2ccccc2-c2cc3c4c5ccccc5ccc4n(-c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)cc4)c3cc21.CC1(C)c2ccccc2-c2cc3c4c5ccccc5ccc4n(-c4ccc5c6c(cccc46)-c4ccccc4-5)c3cc21.CC1(C)c2ccccc2-c2cc3c4cc(-c5ccc6sc7ccccc7c6c5)ccc4n(-c4cccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)c4)c3cc21
InChIInChI=1S/C55H35NS.C47H31N.C41H27N/c1-55(2)48-19-7-5-15-39(48)44-30-46-45-28-32(33-22-26-53-47(29-33)40-16-6-8-20-52(40)57-53)21-25-50(45)56(51(46)31-49(44)55)35-12-9-11-34(27-35)36-23-24-43-38-14-4-3-13-37(38)42-18-10-17-41(36)54(42)43;1-47(2)41-17-8-7-14-35(41)39-26-40-44(27-42(39)47)48(43-25-20-28-10-3-4-11-32(28)46(40)43)30-21-18-29(19-22-30)31-23-24-38-34-13-6-5-12-33(34)37-16-9-15-36(31)45(37)38;1-41(2)34-17-8-7-14-28(34)32-22-33-38(23-35(32)41)42(37-20-18-24-10-3-4-11-25(24)40(33)37)36-21-19-30-27-13-6-5-12-26(27)29-15-9-16-31(36)39(29)30/h3-31H,1-2H3;3-27H,1-2H3;3-23H,1-2H3
InChIKeyLWHQHNSWJBELEJ-UHFFFAOYSA-N
MW1885.40 g/mol
LogP39.35
Rot. Bonds6

About 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene

2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene (PubChem CID 159475348) has the molecular formula C143H93N3S and a molecular weight of 1885.40 g/mol. Its IUPAC name is 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene.

Molecular Properties

Compound Name2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene
PubChem CID159475348
Molecular FormulaC143H93N3S
Molecular Weight1885.40 g/mol
Exact Mass1883.71
IUPAC Name2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene
SMILESCC1(C)c2ccccc2-c2cc3c4c5ccccc5ccc4n(-c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)cc4)c3cc21.CC1(C)c2ccccc2-c2cc3c4c5ccccc5ccc4n(-c4ccc5c6c(cccc46)-c4ccccc4-5)c3cc21.CC1(C)c2ccccc2-c2cc3c4cc(-c5ccc6sc7ccccc7c6c5)ccc4n(-c4cccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)c4)c3cc21
InChIInChI=1S/C55H35NS.C47H31N.C41H27N/c1-55(2)48-19-7-5-15-39(48)44-30-46-45-28-32(33-22-26-53-47(29-33)40-16-6-8-20-52(40)57-53)21-25-50(45)56(51(46)31-49(44)55)35-12-9-11-34(27-35)36-23-24-43-38-14-4-3-13-37(38)42-18-10-17-41(36)54(42)43;1-47(2)41-17-8-7-14-35(41)39-26-40-44(27-42(39)47)48(43-25-20-28-10-3-4-11-32(28)46(40)43)30-21-18-29(19-22-30)31-23-24-38-34-13-6-5-12-33(34)37-16-9-15-36(31)45(37)38;1-41(2)34-17-8-7-14-28(34)32-22-33-38(23-35(32)41)42(37-20-18-24-10-3-4-11-25(24)40(33)37)36-21-19-30-27-13-6-5-12-26(27)29-15-9-16-31(36)39(29)30/h3-31H,1-2H3;3-27H,1-2H3;3-23H,1-2H3
InChIKeyLWHQHNSWJBELEJ-UHFFFAOYSA-N
XLogP39.35
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms147
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001885.40
LogP ≤ 539.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(9,9-dimethylfluoren-2-yl)carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;7,7-dimethyl-5-phenyl-2-[9-(4-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole;9-(3-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 161187955
10-dibenzothiophen-2-yl-7-(4,6-diphenyl-1,3,5-triazin-2-yl)benzo[c]carbazole;3-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazole
CID 158568095
2-(7-fluoranthen-3-ylbenzo[c]carbazol-10-yl)-5-phenylbenzo[b]carbazole;7-fluoranthen-3-yl-10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole;5-fluoranthen-3-yl-2-(9-phenylcarbazol-3-yl)benzo[b]carbazole;7-fluoranthen-3-yl-10-(9-phenylcarbazol-3-yl)benzo[c]carbazole;5-(3-fluoranthen-3-ylphenyl)-2-(9-phenylcarbazol-3-yl)benzo[b]carbazole;7-(3-fluoranthen-3-ylphenyl)-10-(9-phenylcarbazol-3-yl)benzo[c]carbazole
CID 161437853
5-[2-(4-dibenzothiophen-2-ylphenyl)-4-(9-phenylcarbazol-3-yl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 126592258
12-(4-fluoranthen-3-ylphenyl)-16-thia-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 118580828
2-(3-dibenzothiophen-4-ylphenyl)-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
CID 118013996
N-(9,9-dimethylfluoren-2-yl)-N-phenyl-8-(7-phenylbenzo[c]carbazol-10-yl)dibenzothiophen-2-amine
CID 70853892
2-[9-(3-fluoranthen-3-ylphenyl)carbazol-3-yl]-5-phenylbenzo[b]carbazole;10-[9-(3-fluoranthen-3-ylphenyl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;9-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159571919
7,7-dimethyl-5-phenyl-2-(4-phenylnaphthalen-1-yl)indeno[2,1-b]carbazole
CID 170395420
7-fluoranthen-3-yl-10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole
CID 137420887
N-[3-[9-(9,9-dimethylfluoren-2-yl)-16-thia-9-azahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3(8),4,6,11,13,15(23),17,19,21-undecaen-5-yl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N,N-diphenyl-4-[4-(9-phenyl-16-thia-9-azahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3(8),4,6,11,13,15(23),17,19,21-undecaen-5-yl)phenyl]aniline;N,9-diphenyl-N-[3-(9-phenyl-16-thia-9-azahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3(8),4,6,11,13,15(23),17,19,21-undecaen-5-yl)phenyl]carbazol-2-amine;N-naphthalen-1-yl-N-[4-(9-phenyl-16-thia-9-azahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3(8),4,6,11,13,15(23),17,19,21-undecaen-5-yl)phenyl]naphthalen-2-amine;N-phenyl-N-(4-phenylphenyl)-3-(9-phenyl-16-thia-9-azahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3(8),4,6,11,13,15(23),17,19,21-undecaen-5-yl)aniline;N-phenyl-N-[2-[9-(3-phenylphenyl)-16-thia-9-azahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3(8),4,6,11,13,15(23),17,19,21-undecaen-5-yl]phenyl]naphthalen-1-amine
CID 158622482
3-[9-(7,7-dimethylfluoreno[2,3-b][1]benzothiol-9-yl)carbazol-3-yl]-9-phenylcarbazole
CID 118099006

Frequently Asked Questions

What is the IUPAC name of 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene?
The IUPAC name of 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene (CID 159475348) is 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene.
What is the SMILES notation for 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene?
The canonical SMILES for 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene is CC1(C)c2ccccc2-c2cc3c4c5ccccc5ccc4n(-c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)cc4)c3cc21.CC1(C)c2ccccc2-c2cc3c4c5ccccc5ccc4n(-c4ccc5c6c(cccc46)-c4ccccc4-5)c3cc21.CC1(C)c2ccccc2-c2cc3c4cc(-c5ccc6sc7ccccc7c6c5)ccc4n(-c4cccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)c4)c3cc21.
What is the InChIKey of 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene?
The InChIKey is LWHQHNSWJBELEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35NS.C47H31N.C41H27N/c1-55(2)48-19-7-5-15-39(48)44-30-46-45-28-32(33-22-26-53-47(29-33)40-16-6-8-20-52(40)57-53)21-25-50(45)56(51(46)31-49(44)55)35-12-9-11-34(27-35)36-23-24-43-38-14-4-3-13-37(38)42-18-10-17-41(36)54(42)43;1-47(2)41-17-8-7-14-35(41)39-26-40-44(27-42(39)47)48(43-25-20-28-10-3-4-11-32(28)46(40)43)30-21-18-29(19-22-30)31-23-24-38-34-13-6-5-12-33(34)37-16-9-15-36(31)45(37)38;1-41(2)34-17-8-7-14-28(34)32-22-33-38(23-35(32)41)42(37-20-18-24-10-3-4-11-25(24)40(33)37)36-21-19-30-27-13-6-5-12-26(27)29-15-9-16-31(36)39(29)30/h3-31H,1-2H3;3-27H,1-2H3;3-23H,1-2H3.
What are the key properties of 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene?
2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene has a molecular weight of 1885.40 g/mol, XLogP of 39.35, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzothiophen-2-yl-5-(3-fluoranthen-3-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole;12-fluoranthen-3-yl-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene;12-(4-fluoranthen-3-ylphenyl)-16,16-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15(23),17,19,21-undecaene is sourced from PubChem (CID 159475348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).