2-(4-{4-[8-(2,3-Dimethoxy-phenyl)-[1,2,4]-triazolo[1,5-a]pyridin-2-ylamino]-phenyl}-piperidin-1-yl)-N,N-dimethyl-acetamide

HCID 59612468

Basic information

Standard SMILES
COc1cccc(-c2cccn3nc(Nc4ccc(C5CCN(CC(=O)N(C)C)CC5)cc4)nc23)c1OC
InChIKey
DZUZGGJWSCEUDT-UHFFFAOYSA-N
Molecular formula
C29H34N6O3
Average molar mass
514.6 g/mol
Monoisotopic mass
514.26923897

Names & identifiers

Preferred name
2-(4-{4-[8-(2,3-Dimethoxy-phenyl)-[1,2,4]-triazolo[1,5-a]pyridin-2-ylamino]-phenyl}-piperidin-1-yl)-N,N-dimethyl-acetamide
IUPAC
2-[4-[4-[[8-(2,3-dimethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]piperidin-1-yl]-N,N-dimethylacetamide

Names & synonyms

SCHEMBL2640472CHEMBL3645069BDBM99837DZUZGGJWSCEUDT-UHFFFAOYSA-NUS8501936, 3552-(4-{4-[8-(2,3-Dimethoxy-phenyl)-[1,2,4]-triazolo[1,5-a]pyridin-2-ylamino]-phenyl}-piperidin-1-yl)-N,N-dimethyl-acetamide

Database identifiers

PubChem CID
59612468
ChEMBL
CHEMBL3645069

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
84.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
38

Related reactions

3 records

Compound notes

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