N,N-dimethyl-alpha,alpha-diphenyl-4-[[9-(2-pyridinylmethyl)-9H-purin-8-yl]amino]-1-piperidinebutanamide

HCID 53782909
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Basic information

Standard SMILES
CN(C)C(=O)C(CCN1CCC(Nc2nc3cncnc3n2Cc2ccccn2)CC1)(c1ccccc1)c1ccccc1
InChIKey
DWNDYPZDKOJGEB-UHFFFAOYSA-N
Molecular formula
C34H38N8O
Average molar mass
574.7 g/mol

Names & identifiers

Preferred name
N,N-dimethyl-alpha,alpha-diphenyl-4-[[9-(2-pyridinylmethyl)-9H-purin-8-yl]amino]-1-piperidinebutanamide
IUPAC
N,N-dimethyl-2,2-diphenyl-4-[4-[[9-(pyridin-2-ylmethyl)purin-8-yl]amino]piperidin-1-yl]butanamide

Names & synonyms

SCHEMBL9866590DWNDYPZDKOJGEB-UHFFFAOYSA-NN,N-dimethyl-alpha,alpha-diphenyl-4-[[9-(2-pyridinylmethyl)-9H-purin-8-yl]amino]-1-piperidinebutanamide

Database identifiers

PubChem CID
53782909

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
92.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
10
Heavy atoms
43

Related reactions

2 records
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Compound notes

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