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Basic information
- Standard SMILES
Fc1ccccc1COc1cccnc1NC(=S)Nc1ccc(Cl)cc1- InChIKey
CRYNHKUGVBFJJF-UHFFFAOYSA-N- Molecular formula
- C19H15ClFN3OS
- Average molar mass
- 387.9 g/mol
- Monoisotopic mass
- 387.0608391
Names & identifiers
- Preferred name
- N-[3-(2-Fluorobenzyloxy)pyrid-2-yl]-N'-(4-chlorophenyl)thiourea
- IUPAC
- 1-(4-chlorophenyl)-3-[3-[(2-fluorophenyl)methoxy]-2-pyridinyl]thiourea
Names & synonyms
SCHEMBL9125751CRYNHKUGVBFJJF-UHFFFAOYSA-NN-[3-(2-Fluorobenzyloxy)pyrid-2-yl]-N'-(4-chlorophenyl)thiourea
Database identifiers
- PubChem CID
- 20076963
Properties
Computed structural propertiesFilling in
- XLogP
- 4.5
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 451
Related reactions
2 records
Compound notes
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