6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole

C15H9FN2S — CID 142734680

IUPAC6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole
SMILESFc1ccc2nc(-c3ccc4[nH]ccc4c3)sc2c1
InChIInChI=1S/C15H9FN2S/c16-11-2-4-13-14(8-11)19-15(18-13)10-1-3-12-9(7-10)5-6-17-12/h1-8,17H
InChIKeyLBPOWGXEFWPKHY-UHFFFAOYSA-N
MW268.32 g/mol
LogP4.58
Rot. Bonds1

About 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole

6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole (PubChem CID 142734680) has the molecular formula C15H9FN2S and a molecular weight of 268.32 g/mol. Its IUPAC name is 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole.

Molecular Properties

Compound Name6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole
PubChem CID142734680
Molecular FormulaC15H9FN2S
Molecular Weight268.32 g/mol
Exact Mass268.05
IUPAC Name6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole
SMILESFc1ccc2nc(-c3ccc4[nH]ccc4c3)sc2c1
InChIInChI=1S/C15H9FN2S/c16-11-2-4-13-14(8-11)19-15(18-13)10-1-3-12-9(7-10)5-6-17-12/h1-8,17H
InChIKeyLBPOWGXEFWPKHY-UHFFFAOYSA-N
XLogP4.58
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole?
The IUPAC name of 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole (CID 142734680) is 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole.
What is the SMILES notation for 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole?
The canonical SMILES for 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole is Fc1ccc2nc(-c3ccc4[nH]ccc4c3)sc2c1.
What is the InChIKey of 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole?
The InChIKey is LBPOWGXEFWPKHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9FN2S/c16-11-2-4-13-14(8-11)19-15(18-13)10-1-3-12-9(7-10)5-6-17-12/h1-8,17H.
What are the key properties of 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole?
6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole has a molecular weight of 268.32 g/mol, XLogP of 4.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(1H-indol-5-yl)-1,3-benzothiazole is sourced from PubChem (CID 142734680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).