Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCN(CCNC(=O)Nc2ccccc2)CC1- InChIKey
LFMJHWQKCDMRPL-UHFFFAOYSA-N- Molecular formula
- C18H28N4O3
- Average molar mass
- 348.4 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 4-(2-(3-phenylureido)ethyl)piperazine-1-carboxylate
- IUPAC
- tert-butyl 4-[2-(phenylcarbamoylamino)ethyl]piperazine-1-carboxylate
Names & synonyms
Oprea1_733456SCHEMBL210727LFMJHWQKCDMRPL-UHFFFAOYSA-NAKOS029603935Z643397598tert-butyl 4-(2-(3-phenylureido)ethyl)piperazine-1-carboxylate
Database identifiers
- PubChem CID
- 2822252
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 436
Related reactions
1 records
Compound notes
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