N-(4-ethoxyphenyl)-4-[2-[(4-ethoxyphenyl)carbamoylamino]ethyl]piperazine-1-carboxamide
Basic information
- CAS
6951-26-4- Standard SMILES
CCOc1ccc(NC(=O)NCCN2CCN(C(=O)Nc3ccc(OCC)cc3)CC2)cc1- InChIKey
ZBCSTIWTVQLBFI-UHFFFAOYSA-N- Molecular formula
- C24H33N5O4
- Average molar mass
- 455.5 g/mol
- Monoisotopic mass
- 455.25325455
Names & identifiers
- Preferred name
- N-(4-ethoxyphenyl)-4-[2-[(4-ethoxyphenyl)carbamoylamino]ethyl]piperazine-1-carboxamide
- IUPAC
- N-(4-ethoxyphenyl)-4-[2-[(4-ethoxyphenyl)carbamoylamino]ethyl]piperazine-1-carboxamide
Names & synonyms
6951-26-4NSC54697DTXSID80989465NSC-54697N-(4-Ethoxyphenyl)-N'-(2-{4-[(4-ethoxyphenyl)carbamoyl]piperazin-1-yl}ethyl)carbamimidic acid
Database identifiers
- CAS
6951-26-4- PubChem CID
- 244121
- DTXSID
DTXSID80989465
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 583
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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