N-(3-(2,3,6-Trifluorobenzyloxy)pyrid-2-yl)-N'-(4-chlorophenyl)thiourea
Basic information
- Standard SMILES
Fc1ccc(F)c(COc2cccnc2NC(=S)Nc2ccc(Cl)cc2)c1F- InChIKey
JPFPOTUXNZCGPK-UHFFFAOYSA-N- Molecular formula
- C19H13ClF3N3OS
- Average molar mass
- 423.8 g/mol
Names & identifiers
- Preferred name
- N-(3-(2,3,6-Trifluorobenzyloxy)pyrid-2-yl)-N'-(4-chlorophenyl)thiourea
- IUPAC
- 1-(4-chlorophenyl)-3-[3-[(2,3,6-trifluorophenyl)methoxy]-2-pyridinyl]thiourea
Names & synonyms
N-(3-(2,3,6-Trifluorobenzyloxy)pyrid-2-yl)-N'-(4-chlorophenyl)thioureaN-[3-(2,3,6-trifluorobenzyloxy)pyrid-2-yl]-N'-(4-chlorophenyl)thioureaSCHEMBL9126812JPFPOTUXNZCGPK-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 20077029
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 513
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Related reactions
3 records
Compound notes
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