N-[3-(2-chloro-6-fluorobenzyloxy)pyrid-2-yl]-N'-4-methylphenylthiourea

HCID 20076981

Basic information

Standard SMILES
Cc1ccc(NC(=S)Nc2ncccc2OCc2c(F)cccc2Cl)cc1
InChIKey
YMXUTRBULXTWTJ-UHFFFAOYSA-N
Molecular formula
C20H17ClFN3OS
Average molar mass
401.9 g/mol
Monoisotopic mass
401.0764892

Names & identifiers

Preferred name
N-[3-(2-chloro-6-fluorobenzyloxy)pyrid-2-yl]-N'-4-methylphenylthiourea
IUPAC
1-[3-[(2-chloro-6-fluorophenyl)methoxy]-2-pyridinyl]-3-(4-methylphenyl)thiourea

Names & synonyms

SCHEMBL9125275YMXUTRBULXTWTJ-UHFFFAOYSA-NN-[3-(2-Chloro-6-fluorobenzyloxy)pyrid-2-yl]-N'-(4-methylphenyl)thioureaN-[3-(2-chloro-6-fluorobenzyloxy)pyrid-2-yl]-N'-4-methylphenylthiourea

Database identifiers

PubChem CID
20076981

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
78.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
27

Related reactions

3 records

Compound notes

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