1-(2-Fluoroethyl)-3-[(2-methoxy-3-methylphenyl)methyl]urea
Basic information
- CAS
1044256-85-0- Standard SMILES
COc1c(C)cccc1CNC(=O)NCCF- InChIKey
UHBHJPIDSFITBQ-UHFFFAOYSA-N- Molecular formula
- C12H17FN2O2
- Average molar mass
- 240.27 g/mol
- Monoisotopic mass
- 240.12740595
Names & identifiers
- Preferred name
- 1-(2-Fluoroethyl)-3-[(2-methoxy-3-methylphenyl)methyl]urea
- IUPAC
- 1-(2-fluoroethyl)-3-[(2-methoxy-3-methylphenyl)methyl]urea
Names & synonyms
1044256-85-0SCHEMBL4893856DTXSID101187410N-(2-Fluoroethyl)-N'-[(2-methoxy-3-methylphenyl)methyl]ureaN-(2-Fluoroethyl)-Na(2)-[(2-methoxy-3-methylphenyl)methyl]urea
Database identifiers
- CAS
1044256-85-0- PubChem CID
- 59778676
- DTXSID
DTXSID101187410
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 239
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Compound notes
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