9-[3-(4-methylsulfanylphenyl)phenyl]carbazole

C25H19NS — CID 163866178

IUPAC9-[3-(4-methylsulfanylphenyl)phenyl]carbazole
SMILESCSc1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C25H19NS/c1-27-21-15-13-18(14-16-21)19-7-6-8-20(17-19)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26/h2-17H,1H3
InChIKeyPGVAKPPSJOUOJM-UHFFFAOYSA-N
MW365.50 g/mol
LogP7.17
Rot. Bonds3

About 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole

9-[3-(4-methylsulfanylphenyl)phenyl]carbazole (PubChem CID 163866178) has the molecular formula C25H19NS and a molecular weight of 365.50 g/mol. Its IUPAC name is 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[3-(4-methylsulfanylphenyl)phenyl]carbazole
PubChem CID163866178
Molecular FormulaC25H19NS
Molecular Weight365.50 g/mol
Exact Mass365.12
IUPAC Name9-[3-(4-methylsulfanylphenyl)phenyl]carbazole
SMILESCSc1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C25H19NS/c1-27-21-15-13-18(14-16-21)19-7-6-8-20(17-19)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26/h2-17H,1H3
InChIKeyPGVAKPPSJOUOJM-UHFFFAOYSA-N
XLogP7.17
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.50
LogP ≤ 57.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[3-[4-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041263
9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 23386664
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 118449494
9-[3-[3,6-bis(3-carbazol-9-ylphenyl)carbazol-9-yl]phenyl]-3,6-bis(3-carbazol-9-ylphenyl)carbazole
CID 153162679
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylsulfanylphenyl)phenyl]carbazole
CID 165075520
9-[3-[3-[3-[3-[3-[3-(3-phenylphenyl)phenyl]-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]-3-[9-[3-[3-[3-[3-[3-[3-(3-phenylphenyl)phenyl]-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]carbazole
CID 167244726
9-[3-(3,5-diphenylphenyl)phenyl]-3-[9-[3-[3-[3-[9-[3-(3,5-diphenylphenyl)phenyl]-6-phenylcarbazol-3-yl]carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]-6-phenylcarbazole
CID 129265445
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161418420
3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161279377
9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118014168
3-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-(3-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158435002
3-(4-carbazol-9-ylphenyl)-9-(3-phenylphenyl)carbazole;3-(4-carbazol-9-ylphenyl)-9-(4-phenylphenyl)carbazole;3-(4-carbazol-9-ylphenyl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 159533505

Frequently Asked Questions

What is the IUPAC name of 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole?
The IUPAC name of 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole (CID 163866178) is 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole.
What is the SMILES notation for 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole?
The canonical SMILES for 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole is CSc1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1.
What is the InChIKey of 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole?
The InChIKey is PGVAKPPSJOUOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19NS/c1-27-21-15-13-18(14-16-21)19-7-6-8-20(17-19)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26/h2-17H,1H3.
What are the key properties of 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole?
9-[3-(4-methylsulfanylphenyl)phenyl]carbazole has a molecular weight of 365.50 g/mol, XLogP of 7.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(4-methylsulfanylphenyl)phenyl]carbazole is sourced from PubChem (CID 163866178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).