(7-(4-Amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)(pyrrolidin-1-yl)methanone

HCID 59424653

Notes Reactions

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Basic information

Standard SMILES: Nc1ccc(Oc2ccnc3cc(C(=O)N4CCCC4)sc23)c(F)c1
InChIKey: FUIOQXSUKIZEMG-UHFFFAOYSA-N
Molecular formula: C18H16FN3O2S
Average molar mass: 357.4 g/mol

Names & identifiers

Preferred name: (7-(4-Amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)(pyrrolidin-1-yl)methanone
IUPAC: [7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone

Names & synonyms

SCHEMBL306358FUIOQXSUKIZEMG-UHFFFAOYSA-N(7-(4-Amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)(pyrrolidin-1-yl)methanone

Database identifiers

PubChem CID: 59424653

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 96.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 3
Heavy atoms: 25
Formal charge: 0
Complexity: 491

Related reactions

11 records

New reaction record

HRID 165679As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 418582As productuspto-grants-2012_01

HRID 418583As reactantuspto-grants-2012_01

HRID 418652As reactantuspto-grants-2012_01

HRID 500922As reactantuspto-grants-2010_08

HRID 675224As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 1261366As reactantuspto-grants-2013_06

HRID 1542888As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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