1-fluoro-9-pyridin-2-ylsulfonylcarbazole

C17H11FN2O2S — CID 139262428

IUPAC1-fluoro-9-pyridin-2-ylsulfonylcarbazole
SMILESO=S(=O)(c1ccccn1)n1c2ccccc2c2cccc(F)c21
InChIInChI=1S/C17H11FN2O2S/c18-14-8-5-7-13-12-6-1-2-9-15(12)20(17(13)14)23(21,22)16-10-3-4-11-19-16/h1-11H
InChIKeyZCSMPQLSCKZQKS-UHFFFAOYSA-N
MW326.35 g/mol
LogP3.57
Rot. Bonds2

About 1-fluoro-9-pyridin-2-ylsulfonylcarbazole

1-fluoro-9-pyridin-2-ylsulfonylcarbazole (PubChem CID 139262428) has the molecular formula C17H11FN2O2S and a molecular weight of 326.35 g/mol. Its IUPAC name is 1-fluoro-9-pyridin-2-ylsulfonylcarbazole.

Molecular Properties

Compound Name1-fluoro-9-pyridin-2-ylsulfonylcarbazole
PubChem CID139262428
Molecular FormulaC17H11FN2O2S
Molecular Weight326.35 g/mol
Exact Mass326.05
IUPAC Name1-fluoro-9-pyridin-2-ylsulfonylcarbazole
SMILESO=S(=O)(c1ccccn1)n1c2ccccc2c2cccc(F)c21
InChIInChI=1S/C17H11FN2O2S/c18-14-8-5-7-13-12-6-1-2-9-15(12)20(17(13)14)23(21,22)16-10-3-4-11-19-16/h1-11H
InChIKeyZCSMPQLSCKZQKS-UHFFFAOYSA-N
XLogP3.57
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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Substituted phenylsulfonyltryptamine, 11j
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N-[2-(1H-Indol-3-yl)-ethyl]4-pentyl-benzenesulfonamide
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n1-(4-Aminobenzenesulfonyl)skatole
CID 10356663
N-benzenesulfonylgramine antagonist, 8
CID 11723168

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-9-pyridin-2-ylsulfonylcarbazole?
The IUPAC name of 1-fluoro-9-pyridin-2-ylsulfonylcarbazole (CID 139262428) is 1-fluoro-9-pyridin-2-ylsulfonylcarbazole.
What is the SMILES notation for 1-fluoro-9-pyridin-2-ylsulfonylcarbazole?
The canonical SMILES for 1-fluoro-9-pyridin-2-ylsulfonylcarbazole is O=S(=O)(c1ccccn1)n1c2ccccc2c2cccc(F)c21.
What is the InChIKey of 1-fluoro-9-pyridin-2-ylsulfonylcarbazole?
The InChIKey is ZCSMPQLSCKZQKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN2O2S/c18-14-8-5-7-13-12-6-1-2-9-15(12)20(17(13)14)23(21,22)16-10-3-4-11-19-16/h1-11H.
What are the key properties of 1-fluoro-9-pyridin-2-ylsulfonylcarbazole?
1-fluoro-9-pyridin-2-ylsulfonylcarbazole has a molecular weight of 326.35 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-9-pyridin-2-ylsulfonylcarbazole is sourced from PubChem (CID 139262428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).