N(8)-(2-Methoxy-benzyl)-N(2)-(6-methyl-pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,8-diamine

HCID 59612445

Basic information

Standard SMILES
COc1ccccc1CNc1cccn2nc(Nc3ccc(C)nc3)nc12
InChIKey
LFVNMDRPCRBHPS-UHFFFAOYSA-N
Molecular formula
C20H20N6O
Average molar mass
360.4 g/mol
Monoisotopic mass
360.16985928

Names & identifiers

Preferred name
N(8)-(2-Methoxy-benzyl)-N(2)-(6-methyl-pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,8-diamine
IUPAC
8-N-[(2-methoxyphenyl)methyl]-2-N-(6-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine-2,8-diamine

Names & synonyms

SCHEMBL2634369CHEMBL3645110BDBM99884LFVNMDRPCRBHPS-UHFFFAOYSA-NUS8501936, 403N(8)-(2-Methoxy-benzyl)-N(2)-(6-methyl-pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,8-diamine

Database identifiers

PubChem CID
59612445
ChEMBL
CHEMBL3645110

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
76.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
27

Related reactions

3 records

Linked notes

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