6-(2-chlorophenyl)-7-(4-chlorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

HCID 57799414
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Basic information

Standard SMILES
O=c1[nH]nc2cc(-c3ccc(Cl)cc3)c(-c3ccccc3Cl)cn12
InChIKey
VLNRADPXCYTZOE-UHFFFAOYSA-N
Molecular formula
C18H11Cl2N3O
Average molar mass
356.2 g/mol
Monoisotopic mass
355.0279174

Names & identifiers

Preferred name
6-(2-chlorophenyl)-7-(4-chlorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
IUPAC
6-(2-chlorophenyl)-7-(4-chlorophenyl)-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one

Names & synonyms

SCHEMBL3555401VLNRADPXCYTZOE-UHFFFAOYSA-N6-(2-chlorophenyl)-7-(4-chlorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

Database identifiers

PubChem CID
57799414

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
44.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
24

Related reactions

5 records
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Compound notes

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