5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole

C14H8FN3S — CID 175168061

IUPAC5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole
SMILESFc1ccc2[nH]c3c(-c4cncs4)nccc3c2c1
InChIInChI=1S/C14H8FN3S/c15-8-1-2-11-10(5-8)9-3-4-17-14(13(9)18-11)12-6-16-7-19-12/h1-7,18H
InChIKeyXSBUIYCFZVRNOM-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.98
Rot. Bonds1

About 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole

5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole (PubChem CID 175168061) has the molecular formula C14H8FN3S and a molecular weight of 269.30 g/mol. Its IUPAC name is 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole
PubChem CID175168061
Molecular FormulaC14H8FN3S
Molecular Weight269.30 g/mol
Exact Mass269.04
IUPAC Name5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole
SMILESFc1ccc2[nH]c3c(-c4cncs4)nccc3c2c1
InChIInChI=1S/C14H8FN3S/c15-8-1-2-11-10(5-8)9-3-4-17-14(13(9)18-11)12-6-16-7-19-12/h1-7,18H
InChIKeyXSBUIYCFZVRNOM-UHFFFAOYSA-N
XLogP3.98
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole?
The IUPAC name of 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole (CID 175168061) is 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole.
What is the SMILES notation for 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole?
The canonical SMILES for 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole is Fc1ccc2[nH]c3c(-c4cncs4)nccc3c2c1.
What is the InChIKey of 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole?
The InChIKey is XSBUIYCFZVRNOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8FN3S/c15-8-1-2-11-10(5-8)9-3-4-17-14(13(9)18-11)12-6-16-7-19-12/h1-7,18H.
What are the key properties of 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole?
5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole has a molecular weight of 269.30 g/mol, XLogP of 3.98, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole is sourced from PubChem (CID 175168061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).