9-(benzenesulfonyl)-4-methylcarbazole

C19H15NO2S — CID 14594808

IUPAC9-(benzenesulfonyl)-4-methylcarbazole
SMILESCc1cccc2c1c1ccccc1n2S(=O)(=O)c1ccccc1
InChIInChI=1S/C19H15NO2S/c1-14-8-7-13-18-19(14)16-11-5-6-12-17(16)20(18)23(21,22)15-9-3-2-4-10-15/h2-13H,1H3
InChIKeyOWFLWGLHSZVXGH-UHFFFAOYSA-N
MW321.40 g/mol
LogP4.34
Rot. Bonds2

About 9-(benzenesulfonyl)-4-methylcarbazole

9-(benzenesulfonyl)-4-methylcarbazole (PubChem CID 14594808) has the molecular formula C19H15NO2S and a molecular weight of 321.40 g/mol. Its IUPAC name is 9-(benzenesulfonyl)-4-methylcarbazole.

Molecular Properties

Compound Name9-(benzenesulfonyl)-4-methylcarbazole
PubChem CID14594808
Molecular FormulaC19H15NO2S
Molecular Weight321.40 g/mol
Exact Mass321.08
IUPAC Name9-(benzenesulfonyl)-4-methylcarbazole
SMILESCc1cccc2c1c1ccccc1n2S(=O)(=O)c1ccccc1
InChIInChI=1S/C19H15NO2S/c1-14-8-7-13-18-19(14)16-11-5-6-12-17(16)20(18)23(21,22)15-9-3-2-4-10-15/h2-13H,1H3
InChIKeyOWFLWGLHSZVXGH-UHFFFAOYSA-N
XLogP4.34
TPSA39.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(benzenesulfonyl)-4-methylcarbazole?
The IUPAC name of 9-(benzenesulfonyl)-4-methylcarbazole (CID 14594808) is 9-(benzenesulfonyl)-4-methylcarbazole.
What is the SMILES notation for 9-(benzenesulfonyl)-4-methylcarbazole?
The canonical SMILES for 9-(benzenesulfonyl)-4-methylcarbazole is Cc1cccc2c1c1ccccc1n2S(=O)(=O)c1ccccc1.
What is the InChIKey of 9-(benzenesulfonyl)-4-methylcarbazole?
The InChIKey is OWFLWGLHSZVXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO2S/c1-14-8-7-13-18-19(14)16-11-5-6-12-17(16)20(18)23(21,22)15-9-3-2-4-10-15/h2-13H,1H3.
What are the key properties of 9-(benzenesulfonyl)-4-methylcarbazole?
9-(benzenesulfonyl)-4-methylcarbazole has a molecular weight of 321.40 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(benzenesulfonyl)-4-methylcarbazole is sourced from PubChem (CID 14594808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).