anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene

C209H163N15OS — CID 157326743

IUPACanthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene
SMILESCn1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)ccc21.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3C.Cn1c2ccccc2c2ccc3c4ccccc4n(C)c3c21.Cn1c2ccccc2c2ccccc21.Cn1ccnc1.Cn1cnc2ccccc21.c1ccc(-c2cccc(-c3ccccc3)c2)cc1.c1ccc2c(c1)Cc1ccccc1-2.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)ccc1ccccc12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12.c1ccc2cc3ccccc3cc2c1.c1ccc2ccccc2c1.c1ccncc1.c1ncncn1
InChIInChI=1S/C25H18N2.2C20H16N2.C18H12.C18H14.2C14H10.C13H11N.C13H10.C12H8O.C12H8S.C10H8.C8H8N2.C5H5N.C4H6N2.C3H3N3/c1-26-22-11-5-2-10-20(22)21-16-17(14-15-23(21)26)27-24-12-6-3-8-18(24)19-9-4-7-13-25(19)27;1-21-17-9-5-3-7-13(17)15-12-20-16(11-19(15)21)14-8-4-6-10-18(14)22(20)2;1-21-17-9-5-3-7-13(17)15-11-12-16-14-8-4-6-10-18(14)22(2)20(16)19(15)21;1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18;1-3-8-15(9-4-1)17-12-7-13-18(14-17)16-10-5-2-6-11-16;1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-6-10-8-4-3-7-9(10)5-1;1-10-6-9-7-4-2-3-5-8(7)10;1-2-4-6-5-3-1;1-6-3-2-5-4-6;1-4-2-6-3-5-1/h2-16H,1H3;2*3-12H,1-2H3;1-12H;1-14H;2*1-10H;2-9H,1H3;1-8H,9H2;2*1-8H;1-8H;2-6H,1H3;1-5H;2-4H,1H3;1-3H
InChIKeyBEUVWCXBFQFORP-UHFFFAOYSA-N
MW2932.77 g/mol
LogP54.55
Rot. Bonds3

About anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene

anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene (PubChem CID 157326743) has the molecular formula C209H163N15OS and a molecular weight of 2932.77 g/mol. Its IUPAC name is anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene.

Molecular Properties

Compound Nameanthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene
PubChem CID157326743
Molecular FormulaC209H163N15OS
Molecular Weight2932.77 g/mol
Exact Mass2930.29
IUPAC Nameanthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene
SMILESCn1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)ccc21.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3C.Cn1c2ccccc2c2ccc3c4ccccc4n(C)c3c21.Cn1c2ccccc2c2ccccc21.Cn1ccnc1.Cn1cnc2ccccc21.c1ccc(-c2cccc(-c3ccccc3)c2)cc1.c1ccc2c(c1)Cc1ccccc1-2.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)ccc1ccccc12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12.c1ccc2cc3ccccc3cc2c1.c1ccc2ccccc2c1.c1ccncc1.c1ncncn1
InChIInChI=1S/C25H18N2.2C20H16N2.C18H12.C18H14.2C14H10.C13H11N.C13H10.C12H8O.C12H8S.C10H8.C8H8N2.C5H5N.C4H6N2.C3H3N3/c1-26-22-11-5-2-10-20(22)21-16-17(14-15-23(21)26)27-24-12-6-3-8-18(24)19-9-4-7-13-25(19)27;1-21-17-9-5-3-7-13(17)15-12-20-16(11-19(15)21)14-8-4-6-10-18(14)22(20)2;1-21-17-9-5-3-7-13(17)15-11-12-16-14-8-4-6-10-18(14)22(2)20(16)19(15)21;1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18;1-3-8-15(9-4-1)17-12-7-13-18(14-17)16-10-5-2-6-11-16;1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-6-10-8-4-3-7-9(10)5-1;1-10-6-9-7-4-2-3-5-8(7)10;1-2-4-6-5-3-1;1-6-3-2-5-4-6;1-4-2-6-3-5-1/h2-16H,1H3;2*3-12H,1-2H3;1-12H;1-14H;2*1-10H;2-9H,1H3;1-8H,9H2;2*1-8H;1-8H;2-6H,1H3;1-5H;2-4H,1H3;1-3H
InChIKeyBEUVWCXBFQFORP-UHFFFAOYSA-N
XLogP54.55
TPSA134.85 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds3
Heavy Atoms226
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002932.77
LogP ≤ 554.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene 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

6-Dibenzothiophen-2-yl-3-isocyano-1,9-diphenylcarbazole;3,9-di(dibenzofuran-2-yl)-6-isocyanocarbazole;3-isocyano-6-(1-phenylbenzimidazol-4-yl)-9-[5-[6-(trifluoromethyl)dibenzothiophen-2-yl]-3-pyridinyl]carbazole
CID 160492128
12-Dibenzothiophen-4-yl-23-thia-10-azahexacyclo[12.11.0.02,11.03,8.016,24.017,22]pentacosa-1(25),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene;20-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-18-methyl-10-oxa-15-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;17-methyl-20-(9-phenylcarbazol-3-yl)-10-thia-15,18-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;15-methyl-20-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-10-thia-18-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 161901264
Benzene;benzonitrile;1,1'-biphenyl;tetrakis(tert-butylbenzene);9-tert-butylcarbazole;dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;hexadecakis(2,2-dimethylpropane);fluorobenzene;4-methylpyridine;2-methylpyrimidine;naphthalene;phenanthrene;bis(pyridine);bis(pyrimidine);toluene;trifluoromethylbenzene
CID 164951135
bis(6-tert-butyl-1H-benzimidazole);1-tert-butylcyclopenta-1,3-diene;tris(2-tert-butylcyclopenta-1,3-diene);4-tert-butyl-1,1-difluorocyclohexane;bis(2-tert-butylfuran);3-tert-butyl-1H-indole;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;2-tert-butylnaphthalene;1-tert-butylpiperidine;4-tert-butyl-2H-pyrrole;5-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;6-tert-butylquinoline;2-tert-butylthiophene
CID 165068091
[22-Dibenzothiophen-2-yl-7-(3,5-difluorophenyl)-1',2'-dimethylspiro[3-oxa-22-aza-15-azoniahexacyclo[11.10.0.02,10.04,9.015,23.016,21]tricosa-1(13),2(10),4(9),5,7,11,15(23),16,18,20-decaene-14,6'-pyrido[2,1-a]isoindol-5-ium]-3'-yl]-trimethylsilane
CID 167356195
[18-(8-Fluorodibenzofuran-3-yl)-3-methylidene-11-(2-phenylphenyl)-15-thia-11-aza-4,40-diazonianonacyclo[26.12.0.04,12.05,10.013,25.014,22.016,21.029,34.035,40]tetraconta-4(12),5,7,9,13(25),14(22),16(21),17,19,23,29,31,33,35(40),36,38-hexadecaen-38-yl]-trimethylsilane
CID 174080194
3-[3-[3-[8-Dibenzothiophen-2-yl-1-[8-dibenzothiophen-2-yl-4-[3-[3-(9-pyrimidin-5-ylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-1-yl]dibenzofuran-4-yl]phenyl]phenyl]-9-pyrimidin-5-ylcarbazole
CID 58059158
9-[6-Dibenzofuran-4-yl-9-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]carbazol-3-yl]pyrido[2,3-b]indole
CID 70847783
6-[3-(8-Dibenzofuran-2-yldibenzothiophen-2-yl)carbazol-9-yl]-9-phenylpyrido[2,3-b]indole
CID 89850115
6-Dibenzofuran-2-yl-9-[3-(6-dibenzofuran-2-ylpyrido[2,3-b]indol-9-yl)-1-benzothiophen-5-yl]pyrido[2,3-b]indole
CID 90251047
11-[4-(4-Dibenzofuran-4-ylphenyl)pyrimidin-2-yl]-[1]benzothiolo[3,2-b]carbazole
CID 117827088
12-[6-[4-(4-Dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]-11-phenylindolo[2,3-a]carbazole
CID 117855513

Frequently Asked Questions

What is the IUPAC name of anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene?
The IUPAC name of anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene (CID 157326743) is anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene.
What is the SMILES notation for anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene?
The canonical SMILES for anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene is Cn1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)ccc21.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3C.Cn1c2ccccc2c2ccc3c4ccccc4n(C)c3c21.Cn1c2ccccc2c2ccccc21.Cn1ccnc1.Cn1cnc2ccccc21.c1ccc(-c2cccc(-c3ccccc3)c2)cc1.c1ccc2c(c1)Cc1ccccc1-2.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)ccc1ccccc12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12.c1ccc2cc3ccccc3cc2c1.c1ccc2ccccc2c1.c1ccncc1.c1ncncn1.
What is the InChIKey of anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene?
The InChIKey is BEUVWCXBFQFORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2.2C20H16N2.C18H12.C18H14.2C14H10.C13H11N.C13H10.C12H8O.C12H8S.C10H8.C8H8N2.C5H5N.C4H6N2.C3H3N3/c1-26-22-11-5-2-10-20(22)21-16-17(14-15-23(21)26)27-24-12-6-3-8-18(24)19-9-4-7-13-25(19)27;1-21-17-9-5-3-7-13(17)15-12-20-16(11-19(15)21)14-8-4-6-10-18(14)22(20)2;1-21-17-9-5-3-7-13(17)15-11-12-16-14-8-4-6-10-18(14)22(2)20(16)19(15)21;1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18;1-3-8-15(9-4-1)17-12-7-13-18(14-17)16-10-5-2-6-11-16;1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-6-10-8-4-3-7-9(10)5-1;1-10-6-9-7-4-2-3-5-8(7)10;1-2-4-6-5-3-1;1-6-3-2-5-4-6;1-4-2-6-3-5-1/h2-16H,1H3;2*3-12H,1-2H3;1-12H;1-14H;2*1-10H;2-9H,1H3;1-8H,9H2;2*1-8H;1-8H;2-6H,1H3;1-5H;2-4H,1H3;1-3H.
What are the key properties of anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene?
anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene has a molecular weight of 2932.77 g/mol, XLogP of 54.55, 3 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for anthracene;3-carbazol-9-yl-9-methylcarbazole;dibenzofuran;dibenzothiophene;11,12-dimethylindolo[2,3-a]carbazole;5,11-dimethylindolo[3,2-b]carbazole;1,3-diphenylbenzene;9H-fluorene;1-methylbenzimidazole;9-methylcarbazole;1-methylimidazole;naphthalene;phenanthrene;pyridine;1,3,5-triazine;triphenylene is sourced from PubChem (CID 157326743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).