Basic information
- CAS
89135-35-3- Standard SMILES
CCSC(C(C)C)N(C)C(=O)Nc1ccccc1F- InChIKey
RSIVHWWPOBGMCV-UHFFFAOYSA-N- Molecular formula
- C14H21FN2OS
- Average molar mass
- 284.39 g/mol
- Monoisotopic mass
- 284.13586263
Names & identifiers
- Preferred name
- N-[1-(Ethylsulfanyl)-2-methylpropyl]-N'-(2-fluorophenyl)-N-methylurea
- IUPAC
- 1-(1-ethylsulfanyl-2-methylpropyl)-3-(2-fluorophenyl)-1-methylurea
Names & synonyms
89135-35-3DTXSID90537592N-[1-(Ethylsulfanyl)-2-methylpropyl]-N'-(2-fluorophenyl)-N-methylurea
Database identifiers
- CAS
89135-35-3- PubChem CID
- 13344404
- DTXSID
DTXSID90537592
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 289
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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