{[2-Fluoro-4-(4-fluoro-benzyloxy)-phenylcarbamoyl]-methyl}-carbamic acid tert-butyl ester
Basic information
- Standard SMILES
CC(C)(C)OC(=O)NCC(=O)Nc1ccc(OCc2ccc(F)cc2)cc1F- InChIKey
MZMGHSDOPXTRAQ-UHFFFAOYSA-N- Molecular formula
- C20H22F2N2O4
- Average molar mass
- 392.4 g/mol
Names & identifiers
- Preferred name
- {[2-Fluoro-4-(4-fluoro-benzyloxy)-phenylcarbamoyl]-methyl}-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-[2-[2-fluoro-4-[(4-fluorophenyl)methoxy]anilino]-2-oxoethyl]carbamate
Names & synonyms
SCHEMBL4346816MZMGHSDOPXTRAQ-UHFFFAOYSA-N{[2-Fluoro-4-(4-fluoro-benzyloxy)-phenylcarbamoyl]-methyl}-carbamic acid tert-butyl ester
Database identifiers
- PubChem CID
- 69010933
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 519
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Related reactions
3 records
Compound notes
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