3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine

C13H10N2OS — CID 90467644

IUPAC3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine
SMILESCOc1snc2cc(-c3ccccc3)cnc12
InChIInChI=1S/C13H10N2OS/c1-16-13-12-11(15-17-13)7-10(8-14-12)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyZGRUFHJUXQKHDB-UHFFFAOYSA-N
MW242.30 g/mol
LogP3.37
Rot. Bonds2

About 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine

3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine (PubChem CID 90467644) has the molecular formula C13H10N2OS and a molecular weight of 242.30 g/mol. Its IUPAC name is 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine.

Molecular Properties

Compound Name3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine
PubChem CID90467644
Molecular FormulaC13H10N2OS
Molecular Weight242.30 g/mol
Exact Mass242.05
IUPAC Name3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine
SMILESCOc1snc2cc(-c3ccccc3)cnc12
InChIInChI=1S/C13H10N2OS/c1-16-13-12-11(15-17-13)7-10(8-14-12)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyZGRUFHJUXQKHDB-UHFFFAOYSA-N
XLogP3.37
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Dehydrocrenatine
CID 179485
6-(3,4-Dimethoxyphenyl)-3-phenyl-[1,2]thiazolo[4,3-b]pyridine
CID 90466196
6-(3,4-Dimethoxyphenyl)-3-pyridin-4-yl-[1,2]thiazolo[4,3-b]pyridine
CID 90466336
1-ethyl-4-methoxy-9H-pyrido(3,4-b)indole
CID 5317256
6-(3,4-Dimethoxyphenyl)-3-isopropoxy-isothiazolo[4,3-b]pyridine
CID 122205416
6-(3,4-Dimethoxyphenyl)-3-sec-butoxy-isothiazolo[4,3-b]pyridine
CID 122205417
3-Butoxy-6-(3,4-dimethoxyphenyl)-[1,2]thiazolo[4,3-b]pyridine
CID 122205418
3-Ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine
CID 127034695
3-Isopropoxy-6-(3-thienyl)isothiazolo[4,3-b]pyridine
CID 127036250
6-(3,4-Dimethoxyphenyl)-3-(3-methylbutoxy)-[1,2]thiazolo[4,3-b]pyridine
CID 127037057
3-Cyclohexyloxy-6-(3,4-dimethoxyphenyl)-[1,2]thiazolo[4,3-b]pyridine
CID 127037058
2-Methoxy-4-[3-(1,4-oxazepan-4-yl)-[1,2]thiazolo[4,3-b]pyridin-6-yl]aniline
CID 145953839

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine?
The IUPAC name of 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine (CID 90467644) is 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine.
What is the SMILES notation for 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine?
The canonical SMILES for 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine is COc1snc2cc(-c3ccccc3)cnc12.
What is the InChIKey of 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine?
The InChIKey is ZGRUFHJUXQKHDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2OS/c1-16-13-12-11(15-17-13)7-10(8-14-12)9-5-3-2-4-6-9/h2-8H,1H3.
What are the key properties of 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine?
3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine has a molecular weight of 242.30 g/mol, XLogP of 3.37, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6-phenyl-[1,2]thiazolo[4,3-b]pyridine is sourced from PubChem (CID 90467644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).