1-((3-Fluoro-4-(5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridin-2-yl)phenyl)methyl)azetidin-3-ol

HCID 44601443

Notes Reactions

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Basic information

Standard SMILES: OC1CN(Cc2ccc(-c3nc4ccc(C5(c6ccccc6)CC5)nc4s3)c(F)c2)C1
InChIKey: SJRVYCQTDNRXSQ-UHFFFAOYSA-N
Molecular formula: C25H22FN3OS
Average molar mass: 431.5 g/mol

Names & identifiers

Preferred name: 1-((3-Fluoro-4-(5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridin-2-yl)phenyl)methyl)azetidin-3-ol
IUPAC: 1-[[3-fluoro-4-[5-(1-phenylcyclopropyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]phenyl]methyl]azetidin-3-ol

Names & synonyms

SCHEMBL1661884SJRVYCQTDNRXSQ-UHFFFAOYSA-N1-((3-fluoro-4-(5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridin-2-yl)phenyl)methyl)azetidin-3-ol1-((3-fluoro-4-(5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridine-2-yl)phenyl)methyl)azetidin-3-ol

Database identifiers

PubChem CID: 44601443

Properties

Computed structural properties

XLogP: 4.6
Topological polar surface area: 77.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 31
Formal charge: 0
Complexity: 636

Related reactions

4 records

New reaction record

HRID 90596As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 1177488As productuspto-grants-2010_11

HRID 1177542As reactantuspto-grants-2010_11

HRID 1572954As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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