1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole

C30H19NS — CID 142569531

IUPAC1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole
SMILESc1ccc2c(c1)[nH]c1c(-c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)cccc12
InChIInChI=1S/C30H19NS/c1-3-10-27-23(6-1)25-9-5-8-22(30(25)31-27)20-14-12-19(13-15-20)21-16-17-29-26(18-21)24-7-2-4-11-28(24)32-29/h1-18,31H
InChIKeyIRGJGLFKBHKTRQ-UHFFFAOYSA-N
MW425.56 g/mol
LogP9.02
Rot. Bonds2

About 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole

1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole (PubChem CID 142569531) has the molecular formula C30H19NS and a molecular weight of 425.56 g/mol. Its IUPAC name is 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole.

Molecular Properties

Compound Name1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole
PubChem CID142569531
Molecular FormulaC30H19NS
Molecular Weight425.56 g/mol
Exact Mass425.12
IUPAC Name1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole
SMILESc1ccc2c(c1)[nH]c1c(-c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)cccc12
InChIInChI=1S/C30H19NS/c1-3-10-27-23(6-1)25-9-5-8-22(30(25)31-27)20-14-12-19(13-15-20)21-16-17-29-26(18-21)24-7-2-4-11-28(24)32-29/h1-18,31H
InChIKeyIRGJGLFKBHKTRQ-UHFFFAOYSA-N
XLogP9.02
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.56
LogP ≤ 59.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-(4-dibenzothiophen-2-ylphenyl)-7H-benzo[c]carbazole
CID 142567945
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine
CID 154697158
4-(9H-carbazol-3-yl)-N-(4-dibenzothiophen-2-ylphenyl)aniline
CID 145299761
1-(3-triphenylen-2-ylphenyl)-9H-carbazole
CID 129197617
1-naphtho[2,1-b][1]benzothiol-9-yl-6-phenyl-9H-carbazole
CID 142570567
1-(3,4-diphenylphenyl)-9H-carbazole
CID 141489388
1-[4-(2-bromophenyl)phenyl]-9H-carbazole
CID 175063939
bis[4-(9H-carbazol-1-yl)phenyl]diazene
CID 140514298
2-[4-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)phenyl]dibenzothiophene
CID 59629408
3-(3-carbazol-9-ylphenyl)-9-phenylcarbazole;3-[3-(9H-carbazol-1-yl)-5-(4-phenylphenyl)phenyl]-9-phenylcarbazole;3-[3-dibenzothiophen-4-yl-5-(4-phenylphenyl)phenyl]-9-phenylcarbazole
CID 162194345
4-dibenzothiophen-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)aniline
CID 118406193

Frequently Asked Questions

What is the IUPAC name of 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole?
The IUPAC name of 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole (CID 142569531) is 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole.
What is the SMILES notation for 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole?
The canonical SMILES for 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole is c1ccc2c(c1)[nH]c1c(-c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)cccc12.
What is the InChIKey of 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole?
The InChIKey is IRGJGLFKBHKTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19NS/c1-3-10-27-23(6-1)25-9-5-8-22(30(25)31-27)20-14-12-19(13-15-20)21-16-17-29-26(18-21)24-7-2-4-11-28(24)32-29/h1-18,31H.
What are the key properties of 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole?
1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole has a molecular weight of 425.56 g/mol, XLogP of 9.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole is sourced from PubChem (CID 142569531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).