5-Phenyl-2-[4-(2-pyrrolidin-1-ylethoxymethyl)-1-piperidyl]thieno[2,3-d]pyrimidine

HCID 89579409
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Basic information

Standard SMILES
c1ccc(-c2csc3nc(N4CCC(COCCN5CCCC5)CC4)ncc23)cc1
InChIKey
OAISYTVEIFLVFW-UHFFFAOYSA-N
Molecular formula
C24H30N4OS
Average molar mass
422.6 g/mol
Monoisotopic mass
422.21403277

Names & identifiers

Preferred name
5-Phenyl-2-[4-(2-pyrrolidin-1-ylethoxymethyl)-1-piperidyl]thieno[2,3-d]pyrimidine
IUPAC
5-phenyl-2-[4-(2-pyrrolidin-1-ylethoxymethyl)piperidin-1-yl]thieno[2,3-d]pyrimidine

Names & synonyms

CHEMBL3729800SCHEMBL14964951OAISYTVEIFLVFW-UHFFFAOYSA-N5-phenyl-2-[4-(2-pyrrolidin-1-ylethoxymethyl)-1-piperidyl]thieno[2,3-d]pyrimidine

Database identifiers

PubChem CID
89579409
ChEMBL
CHEMBL3729800

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
69.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
30

Related reactions

1 records
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Compound notes

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