12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole

C42H24N2OS — CID 168744266

IUPAC12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole
SMILESc1ccc2c(c1)oc1cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5cccc6c5sc5ccccc56)c43)c12
InChIInChI=1S/C42H24N2OS/c1-5-16-31-25(11-1)27-23-24-34-40(41(27)44(31)33-18-10-21-37-39(33)30-14-3-7-20-36(30)45-37)29-13-2-6-17-32(29)43(34)35-19-9-15-28-26-12-4-8-22-38(26)46-42(28)35/h1-24H
InChIKeyFIRGVYVFBJGGOV-UHFFFAOYSA-N
MW604.73 g/mol
LogP12.15
Rot. Bonds2

About 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole

12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole (PubChem CID 168744266) has the molecular formula C42H24N2OS and a molecular weight of 604.73 g/mol. Its IUPAC name is 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole
PubChem CID168744266
Molecular FormulaC42H24N2OS
Molecular Weight604.73 g/mol
Exact Mass604.16
IUPAC Name12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole
SMILESc1ccc2c(c1)oc1cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5cccc6c5sc5ccccc56)c43)c12
InChIInChI=1S/C42H24N2OS/c1-5-16-31-25(11-1)27-23-24-34-40(41(27)44(31)33-18-10-21-37-39(33)30-14-3-7-20-36(30)45-37)29-13-2-6-17-32(29)43(34)35-19-9-15-28-26-12-4-8-22-38(26)46-42(28)35/h1-24H
InChIKeyFIRGVYVFBJGGOV-UHFFFAOYSA-N
XLogP12.15
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500604.73
LogP ≤ 512.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole 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

12-dibenzofuran-3-yl-5-phenylindolo[3,2-c]carbazole;12-dibenzothiophen-4-yl-5-phenylindolo[3,2-c]carbazole
CID 164963553
12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole
CID 168744311
12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole
CID 167029676
5-dibenzothiophen-4-yl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole
CID 168744298
12-dibenzothiophen-4-yl-5-(3,5-diphenylphenyl)indolo[3,2-c]carbazole
CID 171414814
12-[2-[2-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole;12-[2-[2-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]phenyl]-[1]benzofuro[3,2-a]carbazole;5-[2-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;12-[2-(2-carbazol-9-ylphenyl)phenyl]-5-phenylindolo[3,2-c]carbazole
CID 159617571
12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-[1]benzofuro[3,2-a]carbazole
CID 163773711
12-(7-dibenzothiophen-4-yldibenzofuran-4-yl)-[1]benzofuro[3,2-a]carbazole
CID 170277042
3-(9-dibenzofuran-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-phenylcarbazole
CID 161380088
12-[9-(3-phenylphenyl)dibenzothiophen-4-yl]-[1]benzofuro[3,2-a]carbazole
CID 170688666
10-dibenzothiophen-4-yl-1,10-diazaheptacyclo[14.12.0.02,14.03,11.04,9.017,22.023,28]octacosa-2(14),3(11),4,6,8,12,15,17,19,21,23,25,27-tridecaene
CID 118331174
30-dibenzothiophen-4-yl-5-oxa-30-azaoctacyclo[19.11.0.02,14.04,12.06,11.015,20.023,31.024,29]dotriaconta-1(32),2,4(12),6,8,10,13,15,17,19,21,23(31),24,26,28-pentadecaene
CID 118361076

Frequently Asked Questions

What is the IUPAC name of 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole?
The IUPAC name of 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole (CID 168744266) is 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole.
What is the SMILES notation for 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole?
The canonical SMILES for 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole is c1ccc2c(c1)oc1cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5cccc6c5sc5ccccc56)c43)c12.
What is the InChIKey of 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole?
The InChIKey is FIRGVYVFBJGGOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H24N2OS/c1-5-16-31-25(11-1)27-23-24-34-40(41(27)44(31)33-18-10-21-37-39(33)30-14-3-7-20-36(30)45-37)29-13-2-6-17-32(29)43(34)35-19-9-15-28-26-12-4-8-22-38(26)46-42(28)35/h1-24H.
What are the key properties of 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole?
12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole has a molecular weight of 604.73 g/mol, XLogP of 12.15, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole is sourced from PubChem (CID 168744266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).