11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole

C134H83N5O3S — CID 162111935

IUPAC11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5oc6ccccc6c5cc43)c3ccccc23)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc5oc6ccccc6c5cc43)cc2)cc1.c1ccc(-c2ccc3ccc(-n4c5ccccc5c5cc6oc7ccccc7c6cc54)cc3c2)cc1.c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc6sc7ccccc7c6cc54)ccc32)cc1
InChIInChI=1S/C36H22N2S.2C34H21NO.C30H19NO/c1-2-10-23(11-3-1)37-31-15-7-4-12-25(31)28-20-24(18-19-33(28)37)38-32-16-8-5-13-26(32)29-22-36-30(21-34(29)38)27-14-6-9-17-35(27)39-36;1-2-8-22(9-3-1)24-15-14-23-16-17-26(19-25(23)18-24)35-31-12-6-4-10-27(31)29-21-34-30(20-32(29)35)28-11-5-7-13-33(28)36-34;1-2-10-22(11-3-1)23-18-19-31(25-13-5-4-12-24(23)25)35-30-16-8-6-14-26(30)28-21-34-29(20-32(28)35)27-15-7-9-17-33(27)36-34;1-2-8-20(9-3-1)21-14-16-22(17-15-21)31-27-12-6-4-10-23(27)25-19-30-26(18-28(25)31)24-11-5-7-13-29(24)32-30/h1-22H;2*1-21H;1-19H
InChIKeyZGGOYCIIIHLFQR-UHFFFAOYSA-N
MW1843.24 g/mol
LogP37.61
Rot. Bonds8

About 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole

11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole (PubChem CID 162111935) has the molecular formula C134H83N5O3S and a molecular weight of 1843.24 g/mol. Its IUPAC name is 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole.

Molecular Properties

Compound Name11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole
PubChem CID162111935
Molecular FormulaC134H83N5O3S
Molecular Weight1843.24 g/mol
Exact Mass1841.62
IUPAC Name11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5oc6ccccc6c5cc43)c3ccccc23)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc5oc6ccccc6c5cc43)cc2)cc1.c1ccc(-c2ccc3ccc(-n4c5ccccc5c5cc6oc7ccccc7c6cc54)cc3c2)cc1.c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc6sc7ccccc7c6cc54)ccc32)cc1
InChIInChI=1S/C36H22N2S.2C34H21NO.C30H19NO/c1-2-10-23(11-3-1)37-31-15-7-4-12-25(31)28-20-24(18-19-33(28)37)38-32-16-8-5-13-26(32)29-22-36-30(21-34(29)38)27-14-6-9-17-35(27)39-36;1-2-8-22(9-3-1)24-15-14-23-16-17-26(19-25(23)18-24)35-31-12-6-4-10-27(31)29-21-34-30(20-32(29)35)28-11-5-7-13-33(28)36-34;1-2-10-22(11-3-1)23-18-19-31(25-13-5-4-12-24(23)25)35-30-16-8-6-14-26(30)28-21-34-29(20-32(28)35)27-15-7-9-17-33(27)36-34;1-2-8-20(9-3-1)21-14-16-22(17-15-21)31-27-12-6-4-10-23(27)25-19-30-26(18-28(25)31)24-11-5-7-13-29(24)32-30/h1-22H;2*1-21H;1-19H
InChIKeyZGGOYCIIIHLFQR-UHFFFAOYSA-N
XLogP37.61
TPSA64.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms143
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001843.24
LogP ≤ 537.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole with MolForge

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Related Compounds

11-dibenzothiophen-3-yl-[1]benzofuro[3,2-b]carbazole;11-(9-naphthalen-1-ylcarbazol-4-yl)-[1]benzofuro[3,2-b]carbazole;11-(9-naphthalen-2-ylcarbazol-4-yl)-[1]benzofuro[3,2-b]carbazole;11-(9-phenylcarbazol-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(9-phenylcarbazol-3-yl)-[1]benzofuro[3,2-b]carbazole;11-(9-phenylcarbazol-4-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole
CID 158315169
11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole;11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole
CID 159253152
3-dibenzofuran-2-yl-9-phenylcarbazole;3-dibenzofuran-2-yl-9-(3-phenylphenyl)carbazole;3-dibenzothiophen-2-yl-9-naphthalen-2-ylcarbazole;3-dibenzothiophen-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
CID 158742909
9-dibenzofuran-2-yl-3-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]carbazole;9-dibenzothiophen-2-yl-3-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]carbazole;2-(9-phenylcarbazol-3-yl)-9-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 157326935
3-[9-(10-oxa-20-thiapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-7-yl)carbazol-3-yl]-9-phenylcarbazole
CID 142497124
3-dibenzofuran-2-yl-9-(4-naphthalen-1-ylphenyl)carbazole;3-dibenzothiophen-2-yl-9-(4-naphthalen-2-ylphenyl)carbazole
CID 159777371
9-dibenzofuran-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-dibenzothiophen-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3,6,9-tris(9-phenylcarbazol-3-yl)carbazole
CID 161382413
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(8-phenyldibenzofuran-2-yl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(8-phenyldibenzothiophen-2-yl)carbazole;9-(8-phenyldibenzothiophen-2-yl)-3-[9-(8-phenyldibenzothiophen-2-yl)carbazol-3-yl]carbazole
CID 161271655
3-dibenzofuran-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
CID 160651391
9-dibenzofuran-2-yl-3-dibenzothiophen-2-ylcarbazole;3-dibenzofuran-2-yl-9-(3-phenylphenyl)carbazole;3,9-di(dibenzothiophen-2-yl)carbazole
CID 158258330
9-carbazol-9-yl-5-[7-(2-dibenzofuran-3-ylquinazolin-4-yl)naphthalen-2-yl]benzo[b]carbazole;9-carbazol-9-yl-5-[7-(2-dibenzothiophen-3-ylquinazolin-4-yl)naphthalen-2-yl]benzo[b]carbazole;9-carbazol-9-yl-5-[4-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]naphthalen-1-yl]benzo[b]carbazole
CID 158649736
11-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-phenylindolo[3,2-b]carbazole;11-[4-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole;11-[4-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole
CID 163809594

Frequently Asked Questions

What is the IUPAC name of 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole?
The IUPAC name of 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole (CID 162111935) is 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole.
What is the SMILES notation for 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole?
The canonical SMILES for 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc5oc6ccccc6c5cc43)c3ccccc23)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc5oc6ccccc6c5cc43)cc2)cc1.c1ccc(-c2ccc3ccc(-n4c5ccccc5c5cc6oc7ccccc7c6cc54)cc3c2)cc1.c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc6sc7ccccc7c6cc54)ccc32)cc1.
What is the InChIKey of 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole?
The InChIKey is ZGGOYCIIIHLFQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22N2S.2C34H21NO.C30H19NO/c1-2-10-23(11-3-1)37-31-15-7-4-12-25(31)28-20-24(18-19-33(28)37)38-32-16-8-5-13-26(32)29-22-36-30(21-34(29)38)27-14-6-9-17-35(27)39-36;1-2-8-22(9-3-1)24-15-14-23-16-17-26(19-25(23)18-24)35-31-12-6-4-10-27(31)29-21-34-30(20-32(29)35)28-11-5-7-13-33(28)36-34;1-2-10-22(11-3-1)23-18-19-31(25-13-5-4-12-24(23)25)35-30-16-8-6-14-26(30)28-21-34-29(20-32(28)35)27-15-7-9-17-33(27)36-34;1-2-8-20(9-3-1)21-14-16-22(17-15-21)31-27-12-6-4-10-23(27)25-19-30-26(18-28(25)31)24-11-5-7-13-29(24)32-30/h1-22H;2*1-21H;1-19H.
What are the key properties of 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole?
11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole has a molecular weight of 1843.24 g/mol, XLogP of 37.61, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-b]carbazole;11-(4-phenylnaphthalen-1-yl)-[1]benzofuro[3,2-b]carbazole;11-(7-phenylnaphthalen-2-yl)-[1]benzofuro[3,2-b]carbazole;11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole is sourced from PubChem (CID 162111935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).