9-(4-phenylsulfanylphenyl)carbazole

C24H17NS — CID 139188928

IUPAC9-(4-phenylsulfanylphenyl)carbazole
SMILESc1ccc(Sc2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C24H17NS/c1-2-8-19(9-3-1)26-20-16-14-18(15-17-20)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h1-17H
InChIKeyATZRWJGFDCOXMJ-UHFFFAOYSA-N
MW351.47 g/mol
LogP6.93
Rot. Bonds3

About 9-(4-phenylsulfanylphenyl)carbazole

9-(4-phenylsulfanylphenyl)carbazole (PubChem CID 139188928) has the molecular formula C24H17NS and a molecular weight of 351.47 g/mol. Its IUPAC name is 9-(4-phenylsulfanylphenyl)carbazole.

Molecular Properties

Compound Name9-(4-phenylsulfanylphenyl)carbazole
PubChem CID139188928
Molecular FormulaC24H17NS
Molecular Weight351.47 g/mol
Exact Mass351.11
IUPAC Name9-(4-phenylsulfanylphenyl)carbazole
SMILESc1ccc(Sc2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C24H17NS/c1-2-8-19(9-3-1)26-20-16-14-18(15-17-20)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h1-17H
InChIKeyATZRWJGFDCOXMJ-UHFFFAOYSA-N
XLogP6.93
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.47
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(4-phenylsulfanylphenyl)carbazole?
The IUPAC name of 9-(4-phenylsulfanylphenyl)carbazole (CID 139188928) is 9-(4-phenylsulfanylphenyl)carbazole.
What is the SMILES notation for 9-(4-phenylsulfanylphenyl)carbazole?
The canonical SMILES for 9-(4-phenylsulfanylphenyl)carbazole is c1ccc(Sc2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of 9-(4-phenylsulfanylphenyl)carbazole?
The InChIKey is ATZRWJGFDCOXMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17NS/c1-2-8-19(9-3-1)26-20-16-14-18(15-17-20)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h1-17H.
What are the key properties of 9-(4-phenylsulfanylphenyl)carbazole?
9-(4-phenylsulfanylphenyl)carbazole has a molecular weight of 351.47 g/mol, XLogP of 6.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-phenylsulfanylphenyl)carbazole is sourced from PubChem (CID 139188928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).